3-nitro-N-[(2R)-4-phenylbutan-2-yl]benzenesulfonamide

Systemtic Name: 3-nitro-N-[(2R)-4-phenylbutan-2-yl]benzenesulfonamide Openeye Name: N-[(1R)-1-methyl-3-phenyl-propyl]-3-nitro-benzenesulfonamide CAS Name: 3-nitro-N-[(2R)-4-phenylbutan-2-yl]benzenesulfonamide IUPAC Name: 3-nitro-N-[(2R)-4-phenylbutan-2-yl]benzenesulfonamide Traditional Name: N-[(1R)-1-methyl-3-phenyl-propyl]-3-nitro-benzenesulfonamide Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

C[C@H](CCC1=CC=CC=C1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O4S/c1-13(10-11-14-6-3-2-4-7-14)17-23(21,22)16-9-5-8-15(12-16)18(19)20/h2-9,12-13,17H,10-11H2,1H3/t13-/m1/s1