(E)-3-[3-methoxy-5-(methoxymethyl)phenyl]-3-quinolin-6-yl-prop-2-enenitrile

Systemtic Name: (E)-3-[3-methoxy-5-(methoxymethyl)phenyl]-3-quinolin-6-yl-prop-2-enenitrile Openeye Name: (E)-3-[3-methoxy-5-(methoxymethyl)phenyl]-3-(6-quinolyl)prop-2-enenitrile CAS Name: (E)-3-[3-methoxy-5-(methoxymethyl)phenyl]-3-(6-quinolinyl)-2-propenenitrile IUPAC Name: (E)-3-[3-methoxy-5-(methoxymethyl)phenyl]-3-quinolin-6-ylprop-2-enenitrile Traditional Name: (E)-3-[3-methoxy-5-(methoxymethyl)phenyl]-3-(6-quinolyl)acrylonitrile Formula: C21H18N2O2 MolecularWeight: 330.37982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCC1=CC(=CC(=C1)C(=CC#N)C2=CC3=C(C=C2)N=CC=C3)OC

Isomeric SMILES

COCC1=CC(=CC(=C1)/C(=C/C#N)/C2=CC3=C(C=C2)N=CC=C3)OC

InChI

InChI=1S/C21H18N2O2/c1-24-14-15-10-18(13-19(11-15)25-2)20(7-8-22)16-5-6-21-17(12-16)4-3-9-23-21/h3-7,9-13H,14H2,1-2H3/b20-7+