2-(1,3-benzodioxol-5-yl)-3-(5-bromanyl-2-prop-2-ynoxy-phenyl)prop-2-enenitrile

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-3-(5-bromanyl-2-prop-2-ynoxy-phenyl)prop-2-enenitrile Openeye Name: 2-(1,3-benzodioxol-5-yl)-3-(5-bromo-2-prop-2-ynoxy-phenyl)prop-2-enenitrile CAS Name: 2-(1,3-benzodioxol-5-yl)-3-(5-bromo-2-prop-2-ynoxyphenyl)-2-propenenitrile IUPAC Name: 2-(1,3-benzodioxol-5-yl)-3-(5-bromo-2-prop-2-ynoxyphenyl)prop-2-enenitrile Traditional Name: 2-(1,3-benzodioxol-5-yl)-3-(5-bromo-2-propargyloxy-phenyl)acrylonitrile Formula: C19H12BrNO3 MolecularWeight: 382.20748

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=C(C=C(C=C1)Br)C=C(C#N)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C#CCOC1=C(C=C(C=C1)Br)C=C(C#N)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H12BrNO3/c1-2-7-22-17-6-4-16(20)9-14(17)8-15(11-21)13-3-5-18-19(10-13)24-12-23-18/h1,3-6,8-10H,7,12H2