4-(azocan-1-yl)-3-nitro-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 4-(azocan-1-yl)-3-nitro-N-propan-2-yl-benzenesulfonamide Openeye Name: 4-(azocan-1-yl)-N-isopropyl-3-nitro-benzenesulfonamide CAS Name: 4-(1-azocanyl)-3-nitro-N-propan-2-ylbenzenesulfonamide IUPAC Name: 4-(azocan-1-yl)-3-nitro-N-propan-2-ylbenzenesulfonamide Traditional Name: 4-(azocan-1-yl)-N-isopropyl-3-nitro-benzenesulfonamide Formula: C16H25N3O4S MolecularWeight: 355.4524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)N2CCCCCCC2)[N+](=O)[O-]

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)N2CCCCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C16H25N3O4S/c1-13(2)17-24(22,23)14-8-9-15(16(12-14)19(20)21)18-10-6-4-3-5-7-11-18/h8-9,12-13,17H,3-7,10-11H2,1-2H3