(E)-3-(3-ethoxy-4-prop-2-ynoxy-phenyl)-2-(3-methylphenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(3-ethoxy-4-prop-2-ynoxy-phenyl)-2-(3-methylphenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(3-ethoxy-4-prop-2-ynoxy-phenyl)-2-(3-methylbenzoyl)prop-2-enenitrile CAS Name: (E)-3-(3-ethoxy-4-prop-2-ynoxyphenyl)-2-[(3-methylphenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(3-ethoxy-4-prop-2-ynoxyphenyl)-2-(3-methylbenzoyl)prop-2-enenitrile Traditional Name: (E)-3-(3-ethoxy-4-propargyloxy-phenyl)-2-m-toluoyl-acrylonitrile Formula: C22H19NO3 MolecularWeight: 345.39116

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)C2=CC(=CC=C2)C)OCC#C

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)C2=CC(=CC=C2)C)OCC#C

InChI

InChI=1S/C22H19NO3/c1-4-11-26-20-10-9-17(14-21(20)25-5-2)13-19(15-23)22(24)18-8-6-7-16(3)12-18/h1,6-10,12-14H,5,11H2,2-3H3/b19-13+