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Chemical ID: 7745371
Chemical ID:
7745371
Name [?]:
None
SMILES [?]:
Cc1cc2c(c(=O)n1CCN(C)C)C(C(=C(O2)N)C(=O)OC)c3ccc(c(c3)OC)OC
InChi [?]:
InChI=1/C23H29N3O6/c1-13-11-17-19(22(27)26(13)10-9-25(2)3)18(20(21(24)32-17)23(28)31-6)14-7-8-15(29-4)16(12-14)30-5/h7-8,11-12,18H,9-10,24H2,1-6H3
InChi Info:
AuxInfo=1/0/N:1,12,13,32,30,22,24,25,10,9,3,28,2,23,26,27,4,14,5,15,16,6,19,18,11,8,7,20,31,29,21,17/E:(2,3)/rA:32cCCCCCCONCCNCCCCCONCOOCCCCCCCOCOC/rB:s1;d2;s3;d4;s5;d6;s2s6;s8;s9;s10;s11;s11;s5;s14;d15;s4s16;s16;s15;d19;s19;s21;s14;s23;d24;s25;d26;d23s27;s27;s29;s26;s31;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C23H29N3O6 |
All Atoms: | 61 |
Heavy Atoms: | 32 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 9.00919 |
Area: | 642.092 |
Solvation: | -7.04311 |
Coulombic: | -76.8987 |
Bond Count [?]
All: | 34 |
Single: | 26 |
Double: | 8 |
Rotors: | 8 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 1.41 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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