4-(azetidin-1-yl)-N-(4-methylcyclohexyl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-(azetidin-1-yl)-N-(4-methylcyclohexyl)-3-nitro-benzenesulfonamide Openeye Name: 4-(azetidin-1-yl)-N-(4-methylcyclohexyl)-3-nitro-benzenesulfonamide CAS Name: 4-(1-azetidinyl)-N-(4-methylcyclohexyl)-3-nitrobenzenesulfonamide IUPAC Name: 4-(azetidin-1-yl)-N-(4-methylcyclohexyl)-3-nitrobenzenesulfonamide Traditional Name: 4-(azetidin-1-yl)-N-(4-methylcyclohexyl)-3-nitro-benzenesulfonamide Formula: C16H23N3O4S MolecularWeight: 353.43652

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NS(=O)(=O)C2=CC(=C(C=C2)N3CCC3)[N+](=O)[O-]

Isomeric SMILES

CC1CCC(CC1)NS(=O)(=O)C2=CC(=C(C=C2)N3CCC3)[N+](=O)[O-]

InChI

InChI=1S/C16H23N3O4S/c1-12-3-5-13(6-4-12)17-24(22,23)14-7-8-15(18-9-2-10-18)16(11-14)19(20)21/h7-8,11-13,17H,2-6,9-10H2,1H3