4-methyl-3-nitro-N-[(1-propylpiperidin-1-ium-4-ylidene)amino]benzenesulfonamide

Systemtic Name: 4-methyl-3-nitro-N-[(1-propylpiperidin-1-ium-4-ylidene)amino]benzenesulfonamide Openeye Name: 4-methyl-3-nitro-N-[(1-propylpiperidin-1-ium-4-ylidene)amino]benzenesulfonamide CAS Name: 4-methyl-3-nitro-N-[(1-propyl-4-piperidin-1-iumylidene)amino]benzenesulfonamide IUPAC Name: 4-methyl-3-nitro-N-[(1-propylpiperidin-1-ium-4-ylidene)amino]benzenesulfonamide Traditional Name: 4-methyl-3-nitro-N-[(1-propylpiperidin-1-ium-4-ylidene)amino]benzenesulfonamide Formula: C15H23N4O4S+ MolecularWeight: 355.43252

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(=NNS(=O)(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-])CC1

Isomeric SMILES

CCC[NH+]1CCC(=NNS(=O)(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-])CC1

InChI

InChI=1S/C15H22N4O4S/c1-3-8-18-9-6-13(7-10-18)16-17-24(22,23)14-5-4-12(2)15(11-14)19(20)21/h4-5,11,17H,3,6-10H2,1-2H3/p+1