3-[3-ethoxy-4-[(2-methylphenyl)methoxy]phenyl]-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile

Systemtic Name: 3-[3-ethoxy-4-[(2-methylphenyl)methoxy]phenyl]-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile Openeye Name: 3-[3-ethoxy-4-(o-tolylmethoxy)phenyl]-2-(p-tolylsulfonyl)prop-2-enenitrile CAS Name: 3-[3-ethoxy-4-[(2-methylphenyl)methoxy]phenyl]-2-(4-methylphenyl)sulfonyl-2-propenenitrile IUPAC Name: 3-[3-ethoxy-4-[(2-methylphenyl)methoxy]phenyl]-2-(4-methylphenyl)sulfonylprop-2-enenitrile Traditional Name: 3-[3-ethoxy-4-(2-methylbenzyl)oxy-phenyl]-2-tosyl-acrylonitrile Formula: C26H25NO4S MolecularWeight: 447.546

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)C)OCC3=CC=CC=C3C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)C)OCC3=CC=CC=C3C

InChI

InChI=1S/C26H25NO4S/c1-4-30-26-16-21(11-14-25(26)31-18-22-8-6-5-7-20(22)3)15-24(17-27)32(28,29)23-12-9-19(2)10-13-23/h5-16H,4,18H2,1-3H3