(E)-3-(3-chloranyl-5-ethoxy-4-oxidanyl-phenyl)-2-(2-methylfuran-3-yl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(3-chloranyl-5-ethoxy-4-oxidanyl-phenyl)-2-(2-methylfuran-3-yl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(3-chloro-5-ethoxy-4-hydroxy-phenyl)-2-(2-methylfuran-3-carbonyl)prop-2-enenitrile CAS Name: (E)-3-(3-chloro-5-ethoxy-4-hydroxyphenyl)-2-[(2-methyl-3-furanyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(3-chloro-5-ethoxy-4-hydroxyphenyl)-2-(2-methylfuran-3-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-(3-chloro-5-ethoxy-4-hydroxy-phenyl)-2-(2-methyl-3-furoyl)acrylonitrile Formula: C17H14ClNO4 MolecularWeight: 331.75036

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14ClNO4/c1-3-22-15-8-11(7-14(18)17(15)21)6-12(9-19)16(20)13-4-5-23-10(13)2/h4-8,21H,3H2,1-2H3/b12-6+