[2-[(4-methylcyclohexyl)amino]-2-oxidanylidene-ethyl] 3-[(2-oxidanylidenepyrrolidin-1-yl)methyl]benzoate

Systemtic Name: [2-[(4-methylcyclohexyl)amino]-2-oxidanylidene-ethyl] 3-[(2-oxidanylidenepyrrolidin-1-yl)methyl]benzoate Openeye Name: [2-[(4-methylcyclohexyl)amino]-2-oxo-ethyl] 3-[(2-oxopyrrolidin-1-yl)methyl]benzoate CAS Name: 3-[(2-oxo-1-pyrrolidinyl)methyl]benzoic acid [2-[(4-methylcyclohexyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(4-methylcyclohexyl)amino]-2-oxoethyl] 3-[(2-oxopyrrolidin-1-yl)methyl]benzoate Traditional Name: 3-[(2-ketopyrrolidino)methyl]benzoic acid [2-keto-2-[(4-methylcyclohexyl)amino]ethyl] ester Formula: C21H28N2O4 MolecularWeight: 372.45802

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NC(=O)COC(=O)C2=CC(=CC=C2)CN3CCCC3=O

Isomeric SMILES

CC1CCC(CC1)NC(=O)COC(=O)C2=CC(=CC=C2)CN3CCCC3=O

InChI

InChI=1S/C21H28N2O4/c1-15-7-9-18(10-8-15)22-19(24)14-27-21(26)17-5-2-4-16(12-17)13-23-11-3-6-20(23)25/h2,4-5,12,15,18H,3,6-11,13-14H2,1H3,(H,22,24)