3-[3-methoxy-4-[(2,4,5-trimethylphenyl)methoxy]phenyl]-2-(phenylsulfonyl)prop-2-enenitrile

Systemtic Name: 3-[3-methoxy-4-[(2,4,5-trimethylphenyl)methoxy]phenyl]-2-(phenylsulfonyl)prop-2-enenitrile Openeye Name: 2-(benzenesulfonyl)-3-[3-methoxy-4-[(2,4,5-trimethylphenyl)methoxy]phenyl]prop-2-enenitrile CAS Name: 2-(benzenesulfonyl)-3-[3-methoxy-4-[(2,4,5-trimethylphenyl)methoxy]phenyl]-2-propenenitrile IUPAC Name: 2-(benzenesulfonyl)-3-[3-methoxy-4-[(2,4,5-trimethylphenyl)methoxy]phenyl]prop-2-enenitrile Traditional Name: 2-besyl-3-[3-methoxy-4-(2,4,5-trimethylbenzyl)oxy-phenyl]acrylonitrile Formula: C26H25NO4S MolecularWeight: 447.546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)COC2=C(C=C(C=C2)C=C(C#N)S(=O)(=O)C3=CC=CC=C3)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1C)COC2=C(C=C(C=C2)C=C(C#N)S(=O)(=O)C3=CC=CC=C3)OC)C

InChI

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