Chemical ID: 6603011

CN(C)c1cccc(c1)C(=O)OCC(=O)Nc2ccc(cc2)C(=O)OC
Chemical ID:
6603011
Name [?]:
(4-methoxycarbonylphenyl)carbamoylmethyl 3-dimethylaminobenzoate
SMILES [?]:
CN(C)c1cccc(c1)C(=O)OCC(=O)Nc2ccc(cc2)C(=O)OC
InChi [?]:
InChI=1/C19H20N2O5/c1-21(2)16-6-4-5-14(11-16)19(24)26-12-17(22)20-15-9-7-13(8-10-15)18(23)25-3/h4-11H,12H2,1-3H3,(H,20,22)
InChi Info:
AuxInfo=1/1/N:1,3,26,6,7,5,19,21,18,22,9,13,20,8,17,4,14,23,10,16,2,15,24,11,25,12/E:(1,2)(7,8)(9,10)/rA:26nCNCCCCCCCCOOCCONCCCCCCCOOC/rB:s1;s2;s2;s4;d5;s6;d7;d4s8;s8;d10;s10;s12;s13;d14;s14;s16;s17;d18;s19;d20;d17s21;s20;d23;s23;s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H20N2O5
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:10.5398
Area:603.392
Solvation:-4.54502
Coulombic:-66.4323
Bond Count [?]
All:27
Single:18
Double:9
Rotors:9
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:356.373
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:2.84
LogP (Chemaxon):2.49

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