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

Systemtic Name: (E)-3-[1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-2-(2-methylphenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-[1-(2-furylmethyl)-2,5-dimethyl-pyrrol-3-yl]-2-(2-methylbenzoyl)prop-2-enenitrile CAS Name: (E)-3-[1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolyl]-2-[(2-methylphenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-[1-(furan-2-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-(2-methylbenzoyl)prop-2-enenitrile Traditional Name: (E)-3-[1-(2-furfuryl)-2,5-dimethyl-pyrrol-3-yl]-2-o-toluoyl-acrylonitrile Formula: C22H20N2O2 MolecularWeight: 344.4064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)C(=CC2=C(N(C(=C2)C)CC3=CC=CO3)C)C#N

Isomeric SMILES

CC1=CC=CC=C1C(=O)/C(=C/C2=C(N(C(=C2)C)CC3=CC=CO3)C)/C#N

InChI

InChI=1S/C22H20N2O2/c1-15-7-4-5-9-21(15)22(25)19(13-23)12-18-11-16(2)24(17(18)3)14-20-8-6-10-26-20/h4-12H,14H2,1-3H3/b19-12+