1,2,4-trimethoxy-5-[(4-methylphenyl)sulfonyl-(4-nitrophenyl)methyl]benzene

Systemtic Name: 1,2,4-trimethoxy-5-[(4-methylphenyl)sulfonyl-(4-nitrophenyl)methyl]benzene Openeye Name: 1,2,4-trimethoxy-5-[(4-nitrophenyl)-(p-tolylsulfonyl)methyl]benzene CAS Name: 1,2,4-trimethoxy-5-[(4-methylphenyl)sulfonyl-(4-nitrophenyl)methyl]benzene IUPAC Name: 1,2,4-trimethoxy-5-[(4-methylphenyl)sulfonyl-(4-nitrophenyl)methyl]benzene Traditional Name: 1,2,4-trimethoxy-5-[(4-nitrophenyl)-tosyl-methyl]benzene Formula: C23H23NO7S MolecularWeight: 457.49622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(C2=CC=C(C=C2)[N+](=O)[O-])C3=CC(=C(C=C3OC)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(C2=CC=C(C=C2)[N+](=O)[O-])C3=CC(=C(C=C3OC)OC)OC

InChI

InChI=1S/C23H23NO7S/c1-15-5-11-18(12-6-15)32(27,28)23(16-7-9-17(10-8-16)24(25)26)19-13-21(30-3)22(31-4)14-20(19)29-2/h5-14,23H,1-4H3