3-[4-[(4-tert-butylphenyl)methoxy]-3-ethoxy-phenyl]-2-(phenylsulfonyl)prop-2-enenitrile

Systemtic Name: 3-[4-[(4-tert-butylphenyl)methoxy]-3-ethoxy-phenyl]-2-(phenylsulfonyl)prop-2-enenitrile Openeye Name: 2-(benzenesulfonyl)-3-[4-[(4-tert-butylphenyl)methoxy]-3-ethoxy-phenyl]prop-2-enenitrile CAS Name: 2-(benzenesulfonyl)-3-[4-[(4-tert-butylphenyl)methoxy]-3-ethoxyphenyl]-2-propenenitrile IUPAC Name: 2-(benzenesulfonyl)-3-[4-[(4-tert-butylphenyl)methoxy]-3-ethoxyphenyl]prop-2-enenitrile Traditional Name: 2-besyl-3-[4-(4-tert-butylbenzyl)oxy-3-ethoxy-phenyl]acrylonitrile Formula: C28H29NO4S MolecularWeight: 475.59916

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)S(=O)(=O)C2=CC=CC=C2)OCC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=C(C#N)S(=O)(=O)C2=CC=CC=C2)OCC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C28H29NO4S/c1-5-32-27-18-22(17-25(19-29)34(30,31)24-9-7-6-8-10-24)13-16-26(27)33-20-21-11-14-23(15-12-21)28(2,3)4/h6-18H,5,20H2,1-4H3