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

Systemtic Name: (E)-N-butyl-2-cyano-3-[2,5-dimethyl-1-(2-methylpropyl)pyrrol-3-yl]prop-2-enamide Openeye Name: (E)-N-butyl-2-cyano-3-(1-isobutyl-2,5-dimethyl-pyrrol-3-yl)prop-2-enamide CAS Name: (E)-N-butyl-2-cyano-3-[2,5-dimethyl-1-(2-methylpropyl)-3-pyrrolyl]-2-propenamide IUPAC Name: (E)-N-butyl-2-cyano-3-[2,5-dimethyl-1-(2-methylpropyl)pyrrol-3-yl]prop-2-enamide Traditional Name: (E)-N-butyl-2-cyano-3-(1-isobutyl-2,5-dimethyl-pyrrol-3-yl)acrylamide Formula: C18H27N3O MolecularWeight: 301.42648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N3O/c1-6-7-8-20-18(22)17(11-19)10-16-9-14(4)21(15(16)5)12-13(2)3/h9-10,13H,6-8,12H2,1-5H3,(H,20,22)/b17-10+