(E)-3-(4-butoxyphenyl)-2-(4-methoxyphenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(4-butoxyphenyl)-2-(4-methoxyphenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(4-butoxyphenyl)-2-(4-methoxybenzoyl)prop-2-enenitrile CAS Name: (E)-3-(4-butoxyphenyl)-2-[(4-methoxyphenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(4-butoxyphenyl)-2-(4-methoxybenzoyl)prop-2-enenitrile Traditional Name: (E)-3-(4-butoxyphenyl)-2-p-anisoyl-acrylonitrile Formula: C21H21NO3 MolecularWeight: 335.39634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C21H21NO3/c1-3-4-13-25-20-9-5-16(6-10-20)14-18(15-22)21(23)17-7-11-19(24-2)12-8-17/h5-12,14H,3-4,13H2,1-2H3/b18-14+