ethyl 3-[1-(1,3-benzodioxol-5-ylmethyl)pyrrol-2-yl]-2-cyano-prop-2-enoate

Systemtic Name: ethyl 3-[1-(1,3-benzodioxol-5-ylmethyl)pyrrol-2-yl]-2-cyano-prop-2-enoate Openeye Name: ethyl 3-[1-(1,3-benzodioxol-5-ylmethyl)pyrrol-2-yl]-2-cyano-prop-2-enoate CAS Name: 3-[1-(1,3-benzodioxol-5-ylmethyl)-2-pyrrolyl]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl 3-[1-(1,3-benzodioxol-5-ylmethyl)pyrrol-2-yl]-2-cyanoprop-2-enoate Traditional Name: 2-cyano-3-(1-piperonylpyrrol-2-yl)acrylic acid ethyl ester Formula: C18H16N2O4 MolecularWeight: 324.33064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC=CN1CC2=CC3=C(C=C2)OCO3)C#N

Isomeric SMILES

CCOC(=O)C(=CC1=CC=CN1CC2=CC3=C(C=C2)OCO3)C#N

InChI

InChI=1S/C18H16N2O4/c1-2-22-18(21)14(10-19)9-15-4-3-7-20(15)11-13-5-6-16-17(8-13)24-12-23-16/h3-9H,2,11-12H2,1H3