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

Systemtic Name: N-(4-methylcyclohexyl)-3-nitro-4-pyrrolidin-1-yl-benzenesulfonamide Openeye Name: N-(4-methylcyclohexyl)-3-nitro-4-pyrrolidin-1-yl-benzenesulfonamide CAS Name: N-(4-methylcyclohexyl)-3-nitro-4-(1-pyrrolidinyl)benzenesulfonamide IUPAC Name: N-(4-methylcyclohexyl)-3-nitro-4-pyrrolidin-1-ylbenzenesulfonamide Traditional Name: N-(4-methylcyclohexyl)-3-nitro-4-pyrrolidino-benzenesulfonamide Formula: C17H25N3O4S MolecularWeight: 367.4631

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NS(=O)(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1CCC(CC1)NS(=O)(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C17H25N3O4S/c1-13-4-6-14(7-5-13)18-25(23,24)15-8-9-16(17(12-15)20(21)22)19-10-2-3-11-19/h8-9,12-14,18H,2-7,10-11H2,1H3