(4-cyanophenyl) 3-nitro-4-piperidin-1-yl-benzoate

Systemtic Name: (4-cyanophenyl) 3-nitro-4-piperidin-1-yl-benzoate Openeye Name: (4-cyanophenyl) 3-nitro-4-(1-piperidyl)benzoate CAS Name: 3-nitro-4-(1-piperidinyl)benzoic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 3-nitro-4-piperidin-1-ylbenzoate Traditional Name: 3-nitro-4-piperidino-benzoic acid (4-cyanophenyl) ester Formula: C19H17N3O4 MolecularWeight: 351.35598

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC3=CC=C(C=C3)C#N)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC3=CC=C(C=C3)C#N)[N+](=O)[O-]

InChI

InChI=1S/C19H17N3O4/c20-13-14-4-7-16(8-5-14)26-19(23)15-6-9-17(18(12-15)22(24)25)21-10-2-1-3-11-21/h4-9,12H,1-3,10-11H2