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

Systemtic Name: (3-ethanoylphenyl) 3-nitro-4-piperidin-1-yl-benzoate Openeye Name: (3-acetylphenyl) 3-nitro-4-(1-piperidyl)benzoate CAS Name: 3-nitro-4-(1-piperidinyl)benzoic acid (3-acetylphenyl) ester IUPAC Name: (3-acetylphenyl) 3-nitro-4-piperidin-1-ylbenzoate Traditional Name: 3-nitro-4-piperidino-benzoic acid (3-acetylphenyl) ester Formula: C20H20N2O5 MolecularWeight: 368.3832

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)OC(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)OC(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N2O5/c1-14(23)15-6-5-7-17(12-15)27-20(24)16-8-9-18(19(13-16)22(25)26)21-10-3-2-4-11-21/h5-9,12-13H,2-4,10-11H2,1H3