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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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