(E)-3-[4-ethyl-2-(4-fluorophenyl)-3-methoxy-6-propan-2-yl-phenyl]prop-2-enenitrile

Systemtic Name: (E)-3-[4-ethyl-2-(4-fluorophenyl)-3-methoxy-6-propan-2-yl-phenyl]prop-2-enenitrile Openeye Name: (E)-3-[4-ethyl-2-(4-fluorophenyl)-6-isopropyl-3-methoxy-phenyl]prop-2-enenitrile CAS Name: (E)-3-[4-ethyl-2-(4-fluorophenyl)-3-methoxy-6-propan-2-ylphenyl]-2-propenenitrile IUPAC Name: (E)-3-[4-ethyl-2-(4-fluorophenyl)-3-methoxy-6-propan-2-ylphenyl]prop-2-enenitrile Traditional Name: (E)-3-[4-ethyl-2-(4-fluorophenyl)-6-isopropyl-3-methoxy-phenyl]acrylonitrile Formula: C21H22FNO MolecularWeight: 323.403883

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C(=C1)C(C)C)C=CC#N)C2=CC=C(C=C2)F)OC

Isomeric SMILES

CCC1=C(C(=C(C(=C1)C(C)C)/C=C/C#N)C2=CC=C(C=C2)F)OC

InChI

InChI=1S/C21H22FNO/c1-5-15-13-19(14(2)3)18(7-6-12-23)20(21(15)24-4)16-8-10-17(22)11-9-16/h6-11,13-14H,5H2,1-4H3/b7-6+