methyl 3-(2-methylpiperidin-1-yl)carbonyl-5-nitro-benzoate

Systemtic Name: methyl 3-(2-methylpiperidin-1-yl)carbonyl-5-nitro-benzoate Openeye Name: methyl 3-(2-methylpiperidine-1-carbonyl)-5-nitro-benzoate CAS Name: 3-[(2-methyl-1-piperidinyl)-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-(2-methylpiperidine-1-carbonyl)-5-nitrobenzoate Traditional Name: 3-(2-methylpiperidine-1-carbonyl)-5-nitro-benzoic acid methyl ester Formula: C15H18N2O5 MolecularWeight: 306.31382

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1CCCCN1C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C15H18N2O5/c1-10-5-3-4-6-16(10)14(18)11-7-12(15(19)22-2)9-13(8-11)17(20)21/h7-10H,3-6H2,1-2H3