(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 2-(4-methylpiperidin-1-yl)-5-nitro-benzoate

Systemtic Name: (2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 2-(4-methylpiperidin-1-yl)-5-nitro-benzoate Openeye Name: (2-oxo-2-pyrrolidin-1-yl-ethyl) 2-(4-methyl-1-piperidyl)-5-nitro-benzoate CAS Name: 2-(4-methyl-1-piperidinyl)-5-nitrobenzoic acid [2-oxo-2-(1-pyrrolidinyl)ethyl] ester IUPAC Name: (2-oxo-2-pyrrolidin-1-ylethyl) 2-(4-methylpiperidin-1-yl)-5-nitrobenzoate Traditional Name: 2-(4-methylpiperidino)-5-nitro-benzoic acid (2-keto-2-pyrrolidino-ethyl) ester Formula: C19H25N3O5 MolecularWeight: 375.4189

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OCC(=O)N3CCCC3

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OCC(=O)N3CCCC3

InChI

InChI=1S/C19H25N3O5/c1-14-6-10-20(11-7-14)17-5-4-15(22(25)26)12-16(17)19(24)27-13-18(23)21-8-2-3-9-21/h4-5,12,14H,2-3,6-11,13H2,1H3