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

Systemtic Name: (E)-3-[1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-2-(phenylcarbonyl)prop-2-enenitrile Openeye Name: (E)-2-benzoyl-3-[1-(2-furylmethyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enenitrile CAS Name: (E)-2-benzoyl-3-[1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolyl]-2-propenenitrile IUPAC Name: (E)-2-benzoyl-3-[1-(furan-2-ylmethyl)-2,5-dimethylpyrrol-3-yl]prop-2-enenitrile Traditional Name: (E)-2-benzoyl-3-[1-(2-furfuryl)-2,5-dimethyl-pyrrol-3-yl]acrylonitrile Formula: C21H18N2O2 MolecularWeight: 330.37982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CO2)C)C=C(C#N)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CO2)C)/C=C(\C#N)/C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H18N2O2/c1-15-11-18(16(2)23(15)14-20-9-6-10-25-20)12-19(13-22)21(24)17-7-4-3-5-8-17/h3-12H,14H2,1-2H3/b19-12+