2-[4-[(E)-3-(2,3-dihydro-1,4-benzoxazin-4-yl)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenoxy]ethanenitrile

Systemtic Name: 2-[4-[(E)-3-(2,3-dihydro-1,4-benzoxazin-4-yl)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenoxy]ethanenitrile Openeye Name: 2-[4-[(E)-3-(2,3-dihydro-1,4-benzoxazin-4-yl)-3-oxo-prop-1-enyl]-2-methoxy-phenoxy]acetonitrile CAS Name: 2-[4-[(E)-3-(2,3-dihydro-1,4-benzoxazin-4-yl)-3-oxoprop-1-enyl]-2-methoxyphenoxy]acetonitrile IUPAC Name: 2-[4-[(E)-3-(2,3-dihydro-1,4-benzoxazin-4-yl)-3-oxoprop-1-enyl]-2-methoxyphenoxy]acetonitrile Traditional Name: 2-[4-[(E)-3-(2,3-dihydro-1,4-benzoxazin-4-yl)-3-keto-prop-1-enyl]-2-methoxy-phenoxy]acetonitrile Formula: C20H18N2O4 MolecularWeight: 350.36792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)N2CCOC3=CC=CC=C32)OCC#N

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)N2CCOC3=CC=CC=C32)OCC#N

InChI

InChI=1S/C20H18N2O4/c1-24-19-14-15(6-8-18(19)25-12-10-21)7-9-20(23)22-11-13-26-17-5-3-2-4-16(17)22/h2-9,14H,11-13H2,1H3/b9-7+