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

Systemtic Name: 4-[[3-[3-methoxy-4-[(2-methylphenyl)carbamoylamino]phenyl]-2-oxidanylidene-1-pyrrolidin-2-yl-propyl]-methyl-amino]benzoic acid Openeye Name: 4-[[3-[3-methoxy-4-(o-tolylcarbamoylamino)phenyl]-2-oxo-1-pyrrolidin-2-yl-propyl]-methyl-amino]benzoic acid CAS Name: 4-[[3-[3-methoxy-4-[[(2-methylanilino)-oxomethyl]amino]phenyl]-2-oxo-1-(2-pyrrolidinyl)propyl]-methylamino]benzoic acid IUPAC Name: 4-[[3-[3-methoxy-4-[(2-methylphenyl)carbamoylamino]phenyl]-2-oxo-1-pyrrolidin-2-ylpropyl]-methylamino]benzoic acid Traditional Name: 4-[[2-keto-3-[3-methoxy-4-(o-tolylcarbamoylamino)phenyl]-1-pyrrolidin-2-yl-propyl]-methyl-amino]benzoic acid Formula: C30H34N4O5 MolecularWeight: 530.61476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)NC2=C(C=C(C=C2)CC(=O)C(C3CCCN3)N(C)C4=CC=C(C=C4)C(=O)O)OC

Isomeric SMILES

CC1=CC=CC=C1NC(=O)NC2=C(C=C(C=C2)CC(=O)C(C3CCCN3)N(C)C4=CC=C(C=C4)C(=O)O)OC

InChI

InChI=1S/C30H34N4O5/c1-19-7-4-5-8-23(19)32-30(38)33-24-15-10-20(18-27(24)39-3)17-26(35)28(25-9-6-16-31-25)34(2)22-13-11-21(12-14-22)29(36)37/h4-5,7-8,10-15,18,25,28,31H,6,9,16-17H2,1-3H3,(H,36,37)(H2,32,33,38)