4-[(1-ethylpiperidin-4-yl)amino]-N-(4-methylcyclohexyl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-[(1-ethylpiperidin-4-yl)amino]-N-(4-methylcyclohexyl)-3-nitro-benzenesulfonamide Openeye Name: 4-[(1-ethyl-4-piperidyl)amino]-N-(4-methylcyclohexyl)-3-nitro-benzenesulfonamide CAS Name: 4-[(1-ethyl-4-piperidinyl)amino]-N-(4-methylcyclohexyl)-3-nitrobenzenesulfonamide IUPAC Name: 4-[(1-ethylpiperidin-4-yl)amino]-N-(4-methylcyclohexyl)-3-nitrobenzenesulfonamide Traditional Name: 4-[(1-ethyl-4-piperidyl)amino]-N-(4-methylcyclohexyl)-3-nitro-benzenesulfonamide Formula: C20H32N4O4S MolecularWeight: 424.55748

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(CC1)NC2=C(C=C(C=C2)S(=O)(=O)NC3CCC(CC3)C)[N+](=O)[O-]

Isomeric SMILES

CCN1CCC(CC1)NC2=C(C=C(C=C2)S(=O)(=O)NC3CCC(CC3)C)[N+](=O)[O-]

InChI

InChI=1S/C20H32N4O4S/c1-3-23-12-10-16(11-13-23)21-19-9-8-18(14-20(19)24(25)26)29(27,28)22-17-6-4-15(2)5-7-17/h8-9,14-17,21-22H,3-7,10-13H2,1-2H3