(3-chlorophenyl)methyl 3-nitro-4-piperidin-1-yl-benzoate

Systemtic Name: (3-chlorophenyl)methyl 3-nitro-4-piperidin-1-yl-benzoate Openeye Name: (3-chlorophenyl)methyl 3-nitro-4-(1-piperidyl)benzoate CAS Name: 3-nitro-4-(1-piperidinyl)benzoic acid (3-chlorophenyl)methyl ester IUPAC Name: (3-chlorophenyl)methyl 3-nitro-4-piperidin-1-ylbenzoate Traditional Name: 3-nitro-4-piperidino-benzoic acid (3-chlorobenzyl) ester Formula: C19H19ClN2O4 MolecularWeight: 374.81816

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC3=CC(=CC=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC3=CC(=CC=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H19ClN2O4/c20-16-6-4-5-14(11-16)13-26-19(23)15-7-8-17(18(12-15)22(24)25)21-9-2-1-3-10-21/h4-8,11-12H,1-3,9-10,13H2