ethyl 3-(3,5-dimethylpiperidin-1-yl)carbonyl-5-nitro-benzoate

Systemtic Name: ethyl 3-(3,5-dimethylpiperidin-1-yl)carbonyl-5-nitro-benzoate Openeye Name: ethyl 3-(3,5-dimethylpiperidine-1-carbonyl)-5-nitro-benzoate CAS Name: 3-[(3,5-dimethyl-1-piperidinyl)-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-(3,5-dimethylpiperidine-1-carbonyl)-5-nitrobenzoate Traditional Name: 3-(3,5-dimethylpiperidine-1-carbonyl)-5-nitro-benzoic acid ethyl ester Formula: C17H22N2O5 MolecularWeight: 334.36698

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)N2CC(CC(C2)C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)N2CC(CC(C2)C)C)[N+](=O)[O-]

InChI

InChI=1S/C17H22N2O5/c1-4-24-17(21)14-6-13(7-15(8-14)19(22)23)16(20)18-9-11(2)5-12(3)10-18/h6-8,11-12H,4-5,9-10H2,1-3H3