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

Systemtic Name: (4-methoxycarbonylphenyl) 3-nitro-4-piperidin-1-yl-benzoate Openeye Name: (4-methoxycarbonylphenyl) 3-nitro-4-(1-piperidyl)benzoate CAS Name: 3-nitro-4-(1-piperidinyl)benzoic acid (4-methoxycarbonylphenyl) ester IUPAC Name: (4-methoxycarbonylphenyl) 3-nitro-4-piperidin-1-ylbenzoate Traditional Name: 3-nitro-4-piperidino-benzoic acid (4-carbomethoxyphenyl) ester Formula: C20H20N2O6 MolecularWeight: 384.3826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N2O6/c1-27-19(23)14-5-8-16(9-6-14)28-20(24)15-7-10-17(18(13-15)22(25)26)21-11-3-2-4-12-21/h5-10,13H,2-4,11-12H2,1H3