(Z)-3-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]-2-pyridin-2-yl-prop-2-enenitrile

Systemtic Name: (Z)-3-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]-2-pyridin-2-yl-prop-2-enenitrile Openeye Name: (Z)-3-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]-2-(2-pyridyl)prop-2-enenitrile CAS Name: (Z)-3-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-3-pyrrolyl]-2-(2-pyridinyl)-2-propenenitrile IUPAC Name: (Z)-3-[1-(1,3-benzodioxol-5-yl)-2,5-dimethylpyrrol-3-yl]-2-pyridin-2-ylprop-2-enenitrile Traditional Name: (Z)-3-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]-2-(2-pyridyl)acrylonitrile Formula: C21H17N3O2 MolecularWeight: 343.37858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC3=C(C=C2)OCO3)C)C=C(C#N)C4=CC=CC=N4

Isomeric SMILES

CC1=CC(=C(N1C2=CC3=C(C=C2)OCO3)C)/C=C(\C#N)/C4=CC=CC=N4

InChI

InChI=1S/C21H17N3O2/c1-14-9-16(10-17(12-22)19-5-3-4-8-23-19)15(2)24(14)18-6-7-20-21(11-18)26-13-25-20/h3-11H,13H2,1-2H3/b17-10+