2-[5-[[(4-cyanophenyl)carbonylamino]methyl]-2-oxidanylidene-1-(3-phenylpropyl)pyrrolidin-3-yl]ethanoic acid

Systemtic Name: 2-[5-[[(4-cyanophenyl)carbonylamino]methyl]-2-oxidanylidene-1-(3-phenylpropyl)pyrrolidin-3-yl]ethanoic acid Openeye Name: 2-[5-[[(4-cyanobenzoyl)amino]methyl]-2-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]acetic acid CAS Name: 2-[5-[[[(4-cyanophenyl)-oxomethyl]amino]methyl]-2-oxo-1-(3-phenylpropyl)-3-pyrrolidinyl]acetic acid IUPAC Name: 2-[5-[[(4-cyanobenzoyl)amino]methyl]-2-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]acetic acid Traditional Name: 2-[5-[[(4-cyanobenzoyl)amino]methyl]-2-keto-1-(3-phenylpropyl)pyrrolidin-3-yl]acetic acid Formula: C24H25N3O4 MolecularWeight: 419.473

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1CNC(=O)C2=CC=C(C=C2)C#N)CCCC3=CC=CC=C3)CC(=O)O

Isomeric SMILES

C1C(C(=O)N(C1CNC(=O)C2=CC=C(C=C2)C#N)CCCC3=CC=CC=C3)CC(=O)O

InChI

InChI=1S/C24H25N3O4/c25-15-18-8-10-19(11-9-18)23(30)26-16-21-13-20(14-22(28)29)24(31)27(21)12-4-7-17-5-2-1-3-6-17/h1-3,5-6,8-11,20-21H,4,7,12-14,16H2,(H,26,30)(H,28,29)