2-methyl-5-nitro-N-(3-phenylpropyl)benzenesulfonamide

Systemtic Name: 2-methyl-5-nitro-N-(3-phenylpropyl)benzenesulfonamide Openeye Name: 2-methyl-5-nitro-N-(3-phenylpropyl)benzenesulfonamide CAS Name: 2-methyl-5-nitro-N-(3-phenylpropyl)benzenesulfonamide IUPAC Name: 2-methyl-5-nitro-N-(3-phenylpropyl)benzenesulfonamide Traditional Name: 2-methyl-5-nitro-N-(3-phenylpropyl)benzenesulfonamide Formula: C16H18N2O4S MolecularWeight: 334.39012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCCCC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCCCC2=CC=CC=C2

InChI

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