2-[2-methoxy-4-[(E)-3-oxidanylidene-3-(4-propoxyphenyl)prop-1-enyl]phenoxy]ethanenitrile

Systemtic Name: 2-[2-methoxy-4-[(E)-3-oxidanylidene-3-(4-propoxyphenyl)prop-1-enyl]phenoxy]ethanenitrile Openeye Name: 2-[2-methoxy-4-[(E)-3-oxo-3-(4-propoxyphenyl)prop-1-enyl]phenoxy]acetonitrile CAS Name: 2-[2-methoxy-4-[(E)-3-oxo-3-(4-propoxyphenyl)prop-1-enyl]phenoxy]acetonitrile IUPAC Name: 2-[2-methoxy-4-[(E)-3-oxo-3-(4-propoxyphenyl)prop-1-enyl]phenoxy]acetonitrile Traditional Name: 2-[4-[(E)-3-keto-3-(4-propoxyphenyl)prop-1-enyl]-2-methoxy-phenoxy]acetonitrile Formula: C21H21NO4 MolecularWeight: 351.39574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)C=CC2=CC(=C(C=C2)OCC#N)OC

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)/C=C/C2=CC(=C(C=C2)OCC#N)OC

InChI

InChI=1S/C21H21NO4/c1-3-13-25-18-8-6-17(7-9-18)19(23)10-4-16-5-11-20(26-14-12-22)21(15-16)24-2/h4-11,15H,3,13-14H2,1-2H3/b10-4+