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

Systemtic Name: N-(1-cyclopropylethyl)-N-[(4-methoxyphenyl)methyl]-4-methyl-3-nitro-benzenesulfonamide Openeye Name: N-(1-cyclopropylethyl)-N-[(4-methoxyphenyl)methyl]-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-(1-cyclopropylethyl)-N-[(4-methoxyphenyl)methyl]-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-(1-cyclopropylethyl)-N-[(4-methoxyphenyl)methyl]-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-(1-cyclopropylethyl)-4-methyl-3-nitro-N-p-anisyl-benzenesulfonamide Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)OC)C(C)C3CC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)OC)C(C)C3CC3)[N+](=O)[O-]

InChI

InChI=1S/C20H24N2O5S/c1-14-4-11-19(12-20(14)22(23)24)28(25,26)21(15(2)17-7-8-17)13-16-5-9-18(27-3)10-6-16/h4-6,9-12,15,17H,7-8,13H2,1-3H3