(E)-3-(4-methoxy-3-oxidanyl-phenyl)-2-(2-methylphenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(4-methoxy-3-oxidanyl-phenyl)-2-(2-methylphenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(3-hydroxy-4-methoxy-phenyl)-2-(2-methylbenzoyl)prop-2-enenitrile CAS Name: (E)-3-(3-hydroxy-4-methoxyphenyl)-2-[(2-methylphenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(3-hydroxy-4-methoxyphenyl)-2-(2-methylbenzoyl)prop-2-enenitrile Traditional Name: (E)-3-(3-hydroxy-4-methoxy-phenyl)-2-o-toluoyl-acrylonitrile Formula: C18H15NO3 MolecularWeight: 293.3166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)C(=CC2=CC(=C(C=C2)OC)O)C#N

Isomeric SMILES

CC1=CC=CC=C1C(=O)/C(=C/C2=CC(=C(C=C2)OC)O)/C#N

InChI

InChI=1S/C18H15NO3/c1-12-5-3-4-6-15(12)18(21)14(11-19)9-13-7-8-17(22-2)16(20)10-13/h3-10,20H,1-2H3/b14-9+