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

Systemtic Name: 2-[[4-(dodecylcarbamoyl)phenyl]methyl-phenyl-amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[N-[[4-(dodecylcarbamoyl)phenyl]methyl]anilino]-2-oxo-acetic acid CAS Name: 2-[N-[[4-[(dodecylamino)-oxomethyl]phenyl]methyl]anilino]-2-oxoacetic acid IUPAC Name: 2-[N-[[4-(dodecylcarbamoyl)phenyl]methyl]anilino]-2-oxoacetic acid Traditional Name: 2-keto-2-(N-[4-(laurylcarbamoyl)benzyl]anilino)acetic acid Formula: C28H38N2O4 MolecularWeight: 466.61232

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H38N2O4/c1-2-3-4-5-6-7-8-9-10-14-21-29-26(31)24-19-17-23(18-20-24)22-30(27(32)28(33)34)25-15-12-11-13-16-25/h11-13,15-20H,2-10,14,21-22H2,1H3,(H,29,31)(H,33,34)