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

Systemtic Name: (E)-2-(furan-2-ylcarbonyl)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-enenitrile Openeye Name: (E)-2-(furan-2-carbonyl)-3-(4-isopentyloxy-3-methoxy-phenyl)prop-2-enenitrile CAS Name: (E)-2-[2-furanyl(oxo)methyl]-3-[3-methoxy-4-(3-methylbutoxy)phenyl]-2-propenenitrile IUPAC Name: (E)-2-(furan-2-carbonyl)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-enenitrile Traditional Name: (E)-2-(2-furoyl)-3-(4-isoamoxy-3-methoxy-phenyl)acrylonitrile Formula: C20H21NO4 MolecularWeight: 339.38504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C=C(C#N)C(=O)C2=CC=CO2)OC

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)C2=CC=CO2)OC

InChI

InChI=1S/C20H21NO4/c1-14(2)8-10-25-17-7-6-15(12-19(17)23-3)11-16(13-21)20(22)18-5-4-9-24-18/h4-7,9,11-12,14H,8,10H2,1-3H3/b16-11+