4-[3-[3-methyl-4-[(2-methylphenyl)carbamoylamino]phenyl]-2-oxidanylidene-1-pyrrolidin-1-yl-propoxy]benzoic acid

Systemtic Name: 4-[3-[3-methyl-4-[(2-methylphenyl)carbamoylamino]phenyl]-2-oxidanylidene-1-pyrrolidin-1-yl-propoxy]benzoic acid Openeye Name: 4-[3-[3-methyl-4-(o-tolylcarbamoylamino)phenyl]-2-oxo-1-pyrrolidin-1-yl-propoxy]benzoic acid CAS Name: 4-[3-[3-methyl-4-[[(2-methylanilino)-oxomethyl]amino]phenyl]-2-oxo-1-(1-pyrrolidinyl)propoxy]benzoic acid IUPAC Name: 4-[3-[3-methyl-4-[(2-methylphenyl)carbamoylamino]phenyl]-2-oxo-1-pyrrolidin-1-ylpropoxy]benzoic acid Traditional Name: 4-[2-keto-3-[3-methyl-4-(o-tolylcarbamoylamino)phenyl]-1-pyrrolidino-propoxy]benzoic acid Formula: C29H31N3O5 MolecularWeight: 501.57354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)NC2=C(C=C(C=C2)CC(=O)C(N3CCCC3)OC4=CC=C(C=C4)C(=O)O)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)NC2=C(C=C(C=C2)CC(=O)C(N3CCCC3)OC4=CC=C(C=C4)C(=O)O)C

InChI

InChI=1S/C29H31N3O5/c1-19-7-3-4-8-24(19)30-29(36)31-25-14-9-21(17-20(25)2)18-26(33)27(32-15-5-6-16-32)37-23-12-10-22(11-13-23)28(34)35/h3-4,7-14,17,27H,5-6,15-16,18H2,1-2H3,(H,34,35)(H2,30,31,36)