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

Systemtic Name: N-methyl-N-[2-(4-methylphenoxy)ethyl]-3-nitro-benzenesulfonamide Openeye Name: N-methyl-N-[2-(4-methylphenoxy)ethyl]-3-nitro-benzenesulfonamide CAS Name: N-methyl-N-[2-(4-methylphenoxy)ethyl]-3-nitrobenzenesulfonamide IUPAC Name: N-methyl-N-[2-(4-methylphenoxy)ethyl]-3-nitrobenzenesulfonamide Traditional Name: N-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)OCCN(C)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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