2-methoxy-6-[(3-methoxyphenyl)-(4-methylphenyl)sulfonyl-methyl]benzenecarbonitrile

Systemtic Name: 2-methoxy-6-[(3-methoxyphenyl)-(4-methylphenyl)sulfonyl-methyl]benzenecarbonitrile Openeye Name: 2-methoxy-6-[(3-methoxyphenyl)-(p-tolylsulfonyl)methyl]benzonitrile CAS Name: 2-methoxy-6-[(3-methoxyphenyl)-(4-methylphenyl)sulfonylmethyl]benzonitrile IUPAC Name: 2-methoxy-6-[(3-methoxyphenyl)-(4-methylphenyl)sulfonylmethyl]benzonitrile Traditional Name: 2-methoxy-6-[(3-methoxyphenyl)-tosyl-methyl]benzonitrile Formula: C23H21NO4S MolecularWeight: 407.48214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(C2=CC(=CC=C2)OC)C3=C(C(=CC=C3)OC)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(C2=CC(=CC=C2)OC)C3=C(C(=CC=C3)OC)C#N

InChI

InChI=1S/C23H21NO4S/c1-16-10-12-19(13-11-16)29(25,26)23(17-6-4-7-18(14-17)27-2)20-8-5-9-22(28-3)21(20)15-24/h4-14,23H,1-3H3