(E)-2-(2-fluorophenyl)carbonyl-3-(7-methoxy-1,3-benzodioxol-5-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(2-fluorophenyl)carbonyl-3-(7-methoxy-1,3-benzodioxol-5-yl)prop-2-enenitrile Openeye Name: (E)-2-(2-fluorobenzoyl)-3-(7-methoxy-1,3-benzodioxol-5-yl)prop-2-enenitrile CAS Name: (E)-2-[(2-fluorophenyl)-oxomethyl]-3-(7-methoxy-1,3-benzodioxol-5-yl)-2-propenenitrile IUPAC Name: (E)-2-(2-fluorobenzoyl)-3-(7-methoxy-1,3-benzodioxol-5-yl)prop-2-enenitrile Traditional Name: (E)-2-(2-fluorobenzoyl)-3-(7-methoxy-1,3-benzodioxol-5-yl)acrylonitrile Formula: C18H12FNO4 MolecularWeight: 325.290583

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCO2)C=C(C#N)C(=O)C3=CC=CC=C3F

Isomeric SMILES

COC1=CC(=CC2=C1OCO2)/C=C(\C#N)/C(=O)C3=CC=CC=C3F

InChI

InChI=1S/C18H12FNO4/c1-22-15-7-11(8-16-18(15)24-10-23-16)6-12(9-20)17(21)13-4-2-3-5-14(13)19/h2-8H,10H2,1H3/b12-6+