4-nitro-N-[1-[(phenylmethyl)amino]propan-2-yl]benzenesulfonamide

Systemtic Name: 4-nitro-N-[1-[(phenylmethyl)amino]propan-2-yl]benzenesulfonamide Openeye Name: N-[2-(benzylamino)-1-methyl-ethyl]-4-nitro-benzenesulfonamide CAS Name: 4-nitro-N-[1-[(phenylmethyl)amino]propan-2-yl]benzenesulfonamide IUPAC Name: N-[1-(benzylamino)propan-2-yl]-4-nitrobenzenesulfonamide Traditional Name: N-[2-(benzylamino)-1-methyl-ethyl]-4-nitro-benzenesulfonamide Formula: C16H19N3O4S MolecularWeight: 349.40476

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNCC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(CNCC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H19N3O4S/c1-13(11-17-12-14-5-3-2-4-6-14)18-24(22,23)16-9-7-15(8-10-16)19(20)21/h2-10,13,17-18H,11-12H2,1H3