(E)-2-cyano-3-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]-N-(3-ethoxypropyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]-N-(3-ethoxypropyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-[2,5-dimethyl-1-(p-tolyl)pyrrol-3-yl]-N-(3-ethoxypropyl)prop-2-enamide CAS Name: (E)-2-cyano-3-[2,5-dimethyl-1-(4-methylphenyl)-3-pyrrolyl]-N-(3-ethoxypropyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]-N-(3-ethoxypropyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-[2,5-dimethyl-1-(p-tolyl)pyrrol-3-yl]-N-(3-ethoxypropyl)acrylamide Formula: C22H27N3O2 MolecularWeight: 365.46868

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)C(=CC1=C(N(C(=C1)C)C2=CC=C(C=C2)C)C)C#N

Isomeric SMILES

CCOCCCNC(=O)/C(=C/C1=C(N(C(=C1)C)C2=CC=C(C=C2)C)C)/C#N

InChI

InChI=1S/C22H27N3O2/c1-5-27-12-6-11-24-22(26)20(15-23)14-19-13-17(3)25(18(19)4)21-9-7-16(2)8-10-21/h7-10,13-14H,5-6,11-12H2,1-4H3,(H,24,26)/b20-14+