4-[4-[[(3-methylphenyl)carbonylamino]methyl]-2-(2-naphthalen-1-ylpropanoylamino)phenyl]butanoic acid

Systemtic Name: 4-[4-[[(3-methylphenyl)carbonylamino]methyl]-2-(2-naphthalen-1-ylpropanoylamino)phenyl]butanoic acid Openeye Name: 4-[4-[[(3-methylbenzoyl)amino]methyl]-2-[2-(1-naphthyl)propanoylamino]phenyl]butanoic acid CAS Name: 4-[4-[[[(3-methylphenyl)-oxomethyl]amino]methyl]-2-[[2-(1-naphthalenyl)-1-oxopropyl]amino]phenyl]butanoic acid IUPAC Name: 4-[4-[[(3-methylbenzoyl)amino]methyl]-2-(2-naphthalen-1-ylpropanoylamino)phenyl]butanoic acid Traditional Name: 4-[4-[(m-toluoylamino)methyl]-2-[2-(1-naphthyl)propanoylamino]phenyl]butyric acid Formula: C32H32N2O4 MolecularWeight: 508.60748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NCC2=CC(=C(C=C2)CCCC(=O)O)NC(=O)C(C)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NCC2=CC(=C(C=C2)CCCC(=O)O)NC(=O)C(C)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C32H32N2O4/c1-21-8-5-12-26(18-21)32(38)33-20-23-16-17-25(11-7-15-30(35)36)29(19-23)34-31(37)22(2)27-14-6-10-24-9-3-4-13-28(24)27/h3-6,8-10,12-14,16-19,22H,7,11,15,20H2,1-2H3,(H,33,38)(H,34,37)(H,35,36)