(E)-N-butyl-2-cyano-3-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)prop-2-enamide

Systemtic Name: (E)-N-butyl-2-cyano-3-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)prop-2-enamide Openeye Name: (E)-N-butyl-2-cyano-3-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)prop-2-enamide CAS Name: (E)-N-butyl-2-cyano-3-(2,5-dimethyl-1-propan-2-yl-3-pyrrolyl)-2-propenamide IUPAC Name: (E)-N-butyl-2-cyano-3-(2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)prop-2-enamide Traditional Name: (E)-N-butyl-2-cyano-3-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)acrylamide Formula: C17H25N3O MolecularWeight: 287.3999

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(=CC1=C(N(C(=C1)C)C(C)C)C)C#N

Isomeric SMILES

CCCCNC(=O)/C(=C/C1=C(N(C(=C1)C)C(C)C)C)/C#N

InChI

InChI=1S/C17H25N3O/c1-6-7-8-19-17(21)16(11-18)10-15-9-13(4)20(12(2)3)14(15)5/h9-10,12H,6-8H2,1-5H3,(H,19,21)/b16-10+