2-[3-[[2-(2,5-diphenylpyrrolidin-1-yl)-2-oxidanylidene-ethyl]carbamoylamino]phenyl]ethanoic acid

Systemtic Name: 2-[3-[[2-(2,5-diphenylpyrrolidin-1-yl)-2-oxidanylidene-ethyl]carbamoylamino]phenyl]ethanoic acid Openeye Name: 2-[3-[[2-(2,5-diphenylpyrrolidin-1-yl)-2-oxo-ethyl]carbamoylamino]phenyl]acetic acid CAS Name: 2-[3-[[[[2-(2,5-diphenyl-1-pyrrolidinyl)-2-oxoethyl]amino]-oxomethyl]amino]phenyl]acetic acid IUPAC Name: 2-[3-[[2-(2,5-diphenylpyrrolidin-1-yl)-2-oxoethyl]carbamoylamino]phenyl]acetic acid Traditional Name: 2-[3-[[2-(2,5-diphenylpyrrolidino)-2-keto-ethyl]carbamoylamino]phenyl]acetic acid Formula: C27H27N3O4 MolecularWeight: 457.52098

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1C2=CC=CC=C2)C(=O)CNC(=O)NC3=CC=CC(=C3)CC(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1CC(N(C1C2=CC=CC=C2)C(=O)CNC(=O)NC3=CC=CC(=C3)CC(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C27H27N3O4/c31-25(18-28-27(34)29-22-13-7-8-19(16-22)17-26(32)33)30-23(20-9-3-1-4-10-20)14-15-24(30)21-11-5-2-6-12-21/h1-13,16,23-24H,14-15,17-18H2,(H,32,33)(H2,28,29,34)