4-[(3S)-3-methylpiperidin-1-yl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-[(3S)-3-methylpiperidin-1-yl]-3-nitro-benzenesulfonamide Openeye Name: 4-[(3S)-3-methyl-1-piperidyl]-3-nitro-benzenesulfonamide CAS Name: 4-[(3S)-3-methyl-1-piperidinyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-[(3S)-3-methylpiperidin-1-yl]-3-nitrobenzenesulfonamide Traditional Name: 4-[(3S)-3-methylpiperidino]-3-nitro-benzenesulfonamide Formula: C12H17N3O4S MolecularWeight: 299.34608

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCCN(C1)C2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C12H17N3O4S/c1-9-3-2-6-14(8-9)11-5-4-10(20(13,18)19)7-12(11)15(16)17/h4-5,7,9H,2-3,6,8H2,1H3,(H2,13,18,19)/t9-/m0/s1