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

Systemtic Name: (E)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]-2-(phenylcarbonyl)prop-2-enenitrile Openeye Name: (E)-2-benzoyl-3-(4-isopentyloxy-3-methoxy-phenyl)prop-2-enenitrile CAS Name: (E)-2-benzoyl-3-[3-methoxy-4-(3-methylbutoxy)phenyl]-2-propenenitrile IUPAC Name: (E)-2-benzoyl-3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-enenitrile Traditional Name: (E)-2-benzoyl-3-(4-isoamoxy-3-methoxy-phenyl)acrylonitrile Formula: C22H23NO3 MolecularWeight: 349.42292

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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

Isomeric SMILES

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

InChI

InChI=1S/C22H23NO3/c1-16(2)11-12-26-20-10-9-17(14-21(20)25-3)13-19(15-23)22(24)18-7-5-4-6-8-18/h4-10,13-14,16H,11-12H2,1-3H3/b19-13+