propyl 4-[[(3S)-1-cyclohexyl-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]benzoate

Systemtic Name: propyl 4-[[(3S)-1-cyclohexyl-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]benzoate Openeye Name: propyl 4-[[(3S)-1-cyclohexyl-5-oxo-pyrrolidine-3-carbonyl]amino]benzoate CAS Name: 4-[[[(3S)-1-cyclohexyl-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[[(3S)-1-cyclohexyl-5-oxopyrrolidine-3-carbonyl]amino]benzoate Traditional Name: 4-[[(3S)-1-cyclohexyl-5-keto-pyrrolidine-3-carbonyl]amino]benzoic acid propyl ester Formula: C21H28N2O4 MolecularWeight: 372.45802

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2CC(=O)N(C2)C3CCCCC3

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)[C@H]2CC(=O)N(C2)C3CCCCC3

InChI

InChI=1S/C21H28N2O4/c1-2-12-27-21(26)15-8-10-17(11-9-15)22-20(25)16-13-19(24)23(14-16)18-6-4-3-5-7-18/h8-11,16,18H,2-7,12-14H2,1H3,(H,22,25)/t16-/m0/s1