2-[[4-(dodecylcarbamoyl)phenyl]methyl-(1-phenylethyl)amino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[[4-(dodecylcarbamoyl)phenyl]methyl-(1-phenylethyl)amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[[4-(dodecylcarbamoyl)phenyl]methyl-(1-phenylethyl)amino]-2-oxo-acetic acid CAS Name: 2-[[4-[(dodecylamino)-oxomethyl]phenyl]methyl-(1-phenylethyl)amino]-2-oxoacetic acid IUPAC Name: 2-[[4-(dodecylcarbamoyl)phenyl]methyl-(1-phenylethyl)amino]-2-oxoacetic acid Traditional Name: 2-keto-2-[[4-(laurylcarbamoyl)benzyl]-(1-phenylethyl)amino]acetic acid Formula: C30H42N2O4 MolecularWeight: 494.66548

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC(=O)C1=CC=C(C=C1)CN(C(C)C2=CC=CC=C2)C(=O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCNC(=O)C1=CC=C(C=C1)CN(C(C)C2=CC=CC=C2)C(=O)C(=O)O

InChI

InChI=1S/C30H42N2O4/c1-3-4-5-6-7-8-9-10-11-15-22-31-28(33)27-20-18-25(19-21-27)23-32(29(34)30(35)36)24(2)26-16-13-12-14-17-26/h12-14,16-21,24H,3-11,15,22-23H2,1-2H3,(H,31,33)(H,35,36)