(E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-N-[4-(3-methylphenoxy)phenyl]prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-N-[4-(3-methylphenoxy)phenyl]prop-2-enamide Openeye Name: (E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-N-[4-(3-methylphenoxy)phenyl]prop-2-enamide CAS Name: (E)-2-cyano-3-(2,5-dimethyl-1-propyl-3-pyrrolyl)-N-[4-(3-methylphenoxy)phenyl]-2-propenamide IUPAC Name: (E)-2-cyano-3-(2,5-dimethyl-1-propylpyrrol-3-yl)-N-[4-(3-methylphenoxy)phenyl]prop-2-enamide Traditional Name: (E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-N-[4-(3-methylphenoxy)phenyl]acrylamide Formula: C26H27N3O2 MolecularWeight: 413.51148

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C=C(C#N)C(=O)NC2=CC=C(C=C2)OC3=CC=CC(=C3)C)C

Isomeric SMILES

CCCN1C(=CC(=C1C)/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)OC3=CC=CC(=C3)C)C

InChI

InChI=1S/C26H27N3O2/c1-5-13-29-19(3)15-21(20(29)4)16-22(17-27)26(30)28-23-9-11-24(12-10-23)31-25-8-6-7-18(2)14-25/h6-12,14-16H,5,13H2,1-4H3,(H,28,30)/b22-16+