(E)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]-2-(3-methoxyphenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]-2-(3-methoxyphenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(4-isopentyloxy-3-methoxy-phenyl)-2-(3-methoxybenzoyl)prop-2-enenitrile CAS Name: (E)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]-2-[(3-methoxyphenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-2-(3-methoxybenzoyl)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-enenitrile Traditional Name: (E)-3-(4-isoamoxy-3-methoxy-phenyl)-2-m-anisoyl-acrylonitrile Formula: C23H25NO4 MolecularWeight: 379.4489

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25NO4/c1-16(2)10-11-28-21-9-8-17(13-22(21)27-4)12-19(15-24)23(25)18-6-5-7-20(14-18)26-3/h5-9,12-14,16H,10-11H2,1-4H3/b19-12+