[1-(3-nitrophenyl)carbonylpiperidin-2-yl]methyl 3-nitrobenzoate

Systemtic Name: [1-(3-nitrophenyl)carbonylpiperidin-2-yl]methyl 3-nitrobenzoate Openeye Name: [1-(3-nitrobenzoyl)-2-piperidyl]methyl 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [1-[(3-nitrophenyl)-oxomethyl]-2-piperidinyl]methyl ester IUPAC Name: [1-(3-nitrobenzoyl)piperidin-2-yl]methyl 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [1-(3-nitrobenzoyl)-2-piperidyl]methyl ester Formula: C20H19N3O7 MolecularWeight: 413.38076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)COC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C(C1)COC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O7/c24-19(14-5-3-8-16(11-14)22(26)27)21-10-2-1-7-18(21)13-30-20(25)15-6-4-9-17(12-15)23(28)29/h3-6,8-9,11-12,18H,1-2,7,10,13H2