Chemical ID: 6681668

c1ccc2c(c1)-c3ccccc3C2COC(=O)NNc4ccc(cc4)C(=O)O
Chemical ID:
6681668
Name [?]:
4-(N'-(9H-fluoren-9-ylmethoxycarbonyl)hydrazino)benzoic acid
SMILES [?]:
c1ccc2c(c1)-c3ccccc3C2COC(=O)NNc4ccc(cc4)C(=O)O
InChi [?]:
InChI=1/C22H18N2O4/c25-21(26)14-9-11-15(12-10-14)23-24-22(27)28-13-20-18-7-3-1-5-16(18)17-6-2-4-8-19(17)20/h1-12,20,23H,13H2,(H,24,27)(H,25,26)
InChi Info:
AuxInfo=1/1/N:1,9,2,10,6,8,3,11,22,24,21,25,14,23,20,5,7,4,12,13,26,16,19,18,27,28,17,15/E:(1,2)(3,4)(5,6)(7,8)(9,10)(11,12)(16,17)(18,19)(25,26)/rA:28nCCCCCCCCCCCCCCOCONNCCCCCCCOO/rB:s1;d2;s3;d4;d1s5;s5;s7;d8;s9;d10;d7s11;s4s12;s13;s14;s15;d16;s16;s18;s19;s20;d21;s22;d23;d20s24;s23;d26;s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H18N2O4
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:11.8573
Area:604.209
Solvation:-3.24794
Coulombic:-70.0383
Bond Count [?]
All:31
Single:20
Double:11
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:374.389
H-Bond Donors:3
H-Bond Acceptors:6
XLogP:4.71
LogP (Chemaxon):4.31

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Descriptor Annotations

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