[2-[1-[1-[(4-methylphenyl)methylcarbamoyl]pyrrolidin-2-yl]carbonylpyrrolidin-2-yl]-2-oxidanylidene-ethyl] benzoate

Systemtic Name: [2-[1-[1-[(4-methylphenyl)methylcarbamoyl]pyrrolidin-2-yl]carbonylpyrrolidin-2-yl]-2-oxidanylidene-ethyl] benzoate Openeye Name: [2-oxo-2-[1-[1-(p-tolylmethylcarbamoyl)pyrrolidine-2-carbonyl]pyrrolidin-2-yl]ethyl] benzoate CAS Name: benzoic acid [2-[1-[[1-[[(4-methylphenyl)methylamino]-oxomethyl]-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinyl]-2-oxoethyl] ester IUPAC Name: [2-[1-[1-[(4-methylphenyl)methylcarbamoyl]pyrrolidine-2-carbonyl]pyrrolidin-2-yl]-2-oxoethyl] benzoate Traditional Name: benzoic acid [2-keto-2-[1-[1-[(4-methylbenzyl)carbamoyl]prolyl]pyrrolidin-2-yl]ethyl] ester Formula: C27H31N3O5 MolecularWeight: 477.55214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)N2CCCC2C(=O)N3CCCC3C(=O)COC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)N2CCCC2C(=O)N3CCCC3C(=O)COC(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H31N3O5/c1-19-11-13-20(14-12-19)17-28-27(34)30-16-6-10-23(30)25(32)29-15-5-9-22(29)24(31)18-35-26(33)21-7-3-2-4-8-21/h2-4,7-8,11-14,22-23H,5-6,9-10,15-18H2,1H3,(H,28,34)