(4-nitrophenyl) 3-(4-methylpiperidin-1-yl)sulfonylbenzoate

Systemtic Name: (4-nitrophenyl) 3-(4-methylpiperidin-1-yl)sulfonylbenzoate Openeye Name: (4-nitrophenyl) 3-[(4-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 3-[(4-methyl-1-piperidinyl)sulfonyl]benzoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 3-(4-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 3-(4-methylpiperidino)sulfonylbenzoic acid (4-nitrophenyl) ester Formula: C19H20N2O6S MolecularWeight: 404.4369

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H20N2O6S/c1-14-9-11-20(12-10-14)28(25,26)18-4-2-3-15(13-18)19(22)27-17-7-5-16(6-8-17)21(23)24/h2-8,13-14H,9-12H2,1H3