3-[4-[(4-tert-butylphenyl)methoxy]-3-methoxy-phenyl]-2-(4-chlorophenyl)sulfonyl-prop-2-enenitrile

Systemtic Name: 3-[4-[(4-tert-butylphenyl)methoxy]-3-methoxy-phenyl]-2-(4-chlorophenyl)sulfonyl-prop-2-enenitrile Openeye Name: 3-[4-[(4-tert-butylphenyl)methoxy]-3-methoxy-phenyl]-2-(4-chlorophenyl)sulfonyl-prop-2-enenitrile CAS Name: 3-[4-[(4-tert-butylphenyl)methoxy]-3-methoxyphenyl]-2-(4-chlorophenyl)sulfonyl-2-propenenitrile IUPAC Name: 3-[4-[(4-tert-butylphenyl)methoxy]-3-methoxyphenyl]-2-(4-chlorophenyl)sulfonylprop-2-enenitrile Traditional Name: 3-[4-(4-tert-butylbenzyl)oxy-3-methoxy-phenyl]-2-(4-chlorophenyl)sulfonyl-acrylonitrile Formula: C27H26ClNO4S MolecularWeight: 496.01764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)COC2=C(C=C(C=C2)C=C(C#N)S(=O)(=O)C3=CC=C(C=C3)Cl)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)COC2=C(C=C(C=C2)C=C(C#N)S(=O)(=O)C3=CC=C(C=C3)Cl)OC

InChI

InChI=1S/C27H26ClNO4S/c1-27(2,3)21-8-5-19(6-9-21)18-33-25-14-7-20(16-26(25)32-4)15-24(17-29)34(30,31)23-12-10-22(28)11-13-23/h5-16H,18H2,1-4H3