cyanomethyl (E)-3-[1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enoate

Systemtic Name: cyanomethyl (E)-3-[1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enoate Openeye Name: cyanomethyl (E)-3-[1-(2-furylmethyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enoate CAS Name: (E)-3-[1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolyl]-2-propenoic acid cyanomethyl ester IUPAC Name: cyanomethyl (E)-3-[1-(furan-2-ylmethyl)-2,5-dimethylpyrrol-3-yl]prop-2-enoate Traditional Name: (E)-3-[1-(2-furfuryl)-2,5-dimethyl-pyrrol-3-yl]acrylic acid cyanomethyl ester Formula: C16H16N2O3 MolecularWeight: 284.30984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CO2)C)C=CC(=O)OCC#N

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CO2)C)/C=C/C(=O)OCC#N

InChI

InChI=1S/C16H16N2O3/c1-12-10-14(5-6-16(19)21-9-7-17)13(2)18(12)11-15-4-3-8-20-15/h3-6,8,10H,9,11H2,1-2H3/b6-5+