N-[1-(3-methoxyphenyl)propan-2-yl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[1-(3-methoxyphenyl)propan-2-yl]-4-nitro-benzenesulfonamide Openeye Name: N-[2-(3-methoxyphenyl)-1-methyl-ethyl]-4-nitro-benzenesulfonamide CAS Name: N-[1-(3-methoxyphenyl)propan-2-yl]-4-nitrobenzenesulfonamide IUPAC Name: N-[1-(3-methoxyphenyl)propan-2-yl]-4-nitrobenzenesulfonamide Traditional Name: N-[2-(3-methoxyphenyl)-1-methyl-ethyl]-4-nitro-benzenesulfonamide Formula: C16H18N2O5S MolecularWeight: 350.38952

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC(=CC=C1)OC)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(CC1=CC(=CC=C1)OC)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O5S/c1-12(10-13-4-3-5-15(11-13)23-2)17-24(21,22)16-8-6-14(7-9-16)18(19)20/h3-9,11-12,17H,10H2,1-2H3