(2-aminocarbonyl-5-methoxy-phenyl) 4-(4-methylpiperidin-1-yl)-3-nitro-benzoate

Systemtic Name: (2-aminocarbonyl-5-methoxy-phenyl) 4-(4-methylpiperidin-1-yl)-3-nitro-benzoate Openeye Name: (2-carbamoyl-5-methoxy-phenyl) 4-(4-methyl-1-piperidyl)-3-nitro-benzoate CAS Name: 4-(4-methyl-1-piperidinyl)-3-nitrobenzoic acid (2-carbamoyl-5-methoxyphenyl) ester IUPAC Name: (2-carbamoyl-5-methoxyphenyl) 4-(4-methylpiperidin-1-yl)-3-nitrobenzoate Traditional Name: 4-(4-methylpiperidino)-3-nitro-benzoic acid (2-carbamoyl-5-methoxy-phenyl) ester Formula: C21H23N3O6 MolecularWeight: 413.42382

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC3=C(C=CC(=C3)OC)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC3=C(C=CC(=C3)OC)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O6/c1-13-7-9-23(10-8-13)17-6-3-14(11-18(17)24(27)28)21(26)30-19-12-15(29-2)4-5-16(19)20(22)25/h3-6,11-13H,7-10H2,1-2H3,(H2,22,25)