dimethyl 5-[(1-cyclohexyl-5-oxidanylidene-pyrrolidin-3-yl)carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[(1-cyclohexyl-5-oxidanylidene-pyrrolidin-3-yl)carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[(1-cyclohexyl-5-oxo-pyrrolidine-3-carbonyl)amino]benzene-1,3-dicarboxylate CAS Name: 5-[[(1-cyclohexyl-5-oxo-3-pyrrolidinyl)-oxomethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(1-cyclohexyl-5-oxopyrrolidine-3-carbonyl)amino]benzene-1,3-dicarboxylate Traditional Name: 5-[(1-cyclohexyl-5-keto-pyrrolidine-3-carbonyl)amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C21H26N2O6 MolecularWeight: 402.44094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O6/c1-28-20(26)13-8-14(21(27)29-2)10-16(9-13)22-19(25)15-11-18(24)23(12-15)17-6-4-3-5-7-17/h8-10,15,17H,3-7,11-12H2,1-2H3,(H,22,25)