ethyl 3-[4-(methylcarbamoyl)piperidin-1-yl]carbonyl-5-nitro-benzoate

Systemtic Name: ethyl 3-[4-(methylcarbamoyl)piperidin-1-yl]carbonyl-5-nitro-benzoate Openeye Name: ethyl 3-[4-(methylcarbamoyl)piperidine-1-carbonyl]-5-nitro-benzoate CAS Name: 3-[[4-(methylcarbamoyl)-1-piperidinyl]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[4-(methylcarbamoyl)piperidine-1-carbonyl]-5-nitrobenzoate Traditional Name: 3-[4-(methylcarbamoyl)piperidine-1-carbonyl]-5-nitro-benzoic acid ethyl ester Formula: C17H21N3O6 MolecularWeight: 363.36514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)N2CCC(CC2)C(=O)NC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)N2CCC(CC2)C(=O)NC)[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O6/c1-3-26-17(23)13-8-12(9-14(10-13)20(24)25)16(22)19-6-4-11(5-7-19)15(21)18-2/h8-11H,3-7H2,1-2H3,(H,18,21)