N-[1-(4-methoxyphenyl)-3-methyl-butyl]-4-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-[1-(4-methoxyphenyl)-3-methyl-butyl]-4-methyl-3-nitro-benzenesulfonamide Openeye Name: N-[1-(4-methoxyphenyl)-3-methyl-butyl]-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-[1-(4-methoxyphenyl)-3-methylbutyl]-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-[1-(4-methoxyphenyl)-3-methylbutyl]-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-[1-(4-methoxyphenyl)-3-methyl-butyl]-4-methyl-3-nitro-benzenesulfonamide Formula: C19H24N2O5S MolecularWeight: 392.46926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24N2O5S/c1-13(2)11-18(15-6-8-16(26-4)9-7-15)20-27(24,25)17-10-5-14(3)19(12-17)21(22)23/h5-10,12-13,18,20H,11H2,1-4H3