3-[4-[(4-fluorophenyl)methoxy]-3-methoxy-phenyl]-2-(phenylsulfonyl)prop-2-enenitrile

Systemtic Name: 3-[4-[(4-fluorophenyl)methoxy]-3-methoxy-phenyl]-2-(phenylsulfonyl)prop-2-enenitrile Openeye Name: 2-(benzenesulfonyl)-3-[4-[(4-fluorophenyl)methoxy]-3-methoxy-phenyl]prop-2-enenitrile CAS Name: 2-(benzenesulfonyl)-3-[4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl]-2-propenenitrile IUPAC Name: 2-(benzenesulfonyl)-3-[4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl]prop-2-enenitrile Traditional Name: 2-besyl-3-[4-(4-fluorobenzyl)oxy-3-methoxy-phenyl]acrylonitrile Formula: C23H18FNO4S MolecularWeight: 423.456723

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)S(=O)(=O)C2=CC=CC=C2)OCC3=CC=C(C=C3)F

Isomeric SMILES

COC1=C(C=CC(=C1)C=C(C#N)S(=O)(=O)C2=CC=CC=C2)OCC3=CC=C(C=C3)F

InChI

InChI=1S/C23H18FNO4S/c1-28-23-14-18(9-12-22(23)29-16-17-7-10-19(24)11-8-17)13-21(15-25)30(26,27)20-5-3-2-4-6-20/h2-14H,16H2,1H3