(2-oxidanylidene-2-piperidin-1-yl-ethyl) 3-methyl-2-nitro-benzoate

Systemtic Name: (2-oxidanylidene-2-piperidin-1-yl-ethyl) 3-methyl-2-nitro-benzoate Openeye Name: [2-oxo-2-(1-piperidyl)ethyl] 3-methyl-2-nitro-benzoate CAS Name: 3-methyl-2-nitrobenzoic acid [2-oxo-2-(1-piperidinyl)ethyl] ester IUPAC Name: (2-oxo-2-piperidin-1-ylethyl) 3-methyl-2-nitrobenzoate Traditional Name: 3-methyl-2-nitro-benzoic acid (2-keto-2-piperidino-ethyl) ester Formula: C15H18N2O5 MolecularWeight: 306.31382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)OCC(=O)N2CCCCC2

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)OCC(=O)N2CCCCC2

InChI

InChI=1S/C15H18N2O5/c1-11-6-5-7-12(14(11)17(20)21)15(19)22-10-13(18)16-8-3-2-4-9-16/h5-7H,2-4,8-10H2,1H3