4-methyl-N-[2-(4-methylphenoxy)ethyl]-3-nitro-benzenesulfonamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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