N-(4-azanyl-3-nitro-phenyl)-4-[(2S)-butan-2-yl]benzenesulfonamide

Systemtic Name: N-(4-azanyl-3-nitro-phenyl)-4-[(2S)-butan-2-yl]benzenesulfonamide Openeye Name: N-(4-amino-3-nitro-phenyl)-4-[(1S)-1-methylpropyl]benzenesulfonamide CAS Name: N-(4-amino-3-nitrophenyl)-4-[(2S)-butan-2-yl]benzenesulfonamide IUPAC Name: N-(4-amino-3-nitrophenyl)-4-[(2S)-butan-2-yl]benzenesulfonamide Traditional Name: N-(4-amino-3-nitro-phenyl)-4-[(1S)-1-methylpropyl]benzenesulfonamide Formula: C16H19N3O4S MolecularWeight: 349.40476

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)N)[N+](=O)[O-]

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)N)[N+](=O)[O-]

InChI

InChI=1S/C16H19N3O4S/c1-3-11(2)12-4-7-14(8-5-12)24(22,23)18-13-6-9-15(17)16(10-13)19(20)21/h4-11,18H,3,17H2,1-2H3/t11-/m0/s1