(E)-2-cyano-N-(2-methylcyclohexyl)-3-[1-(4-nitrophenyl)pyrrol-2-yl]prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(2-methylcyclohexyl)-3-[1-(4-nitrophenyl)pyrrol-2-yl]prop-2-enamide Openeye Name: (E)-2-cyano-N-(2-methylcyclohexyl)-3-[1-(4-nitrophenyl)pyrrol-2-yl]prop-2-enamide CAS Name: (E)-2-cyano-N-(2-methylcyclohexyl)-3-[1-(4-nitrophenyl)-2-pyrrolyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-(2-methylcyclohexyl)-3-[1-(4-nitrophenyl)pyrrol-2-yl]prop-2-enamide Traditional Name: (E)-2-cyano-N-(2-methylcyclohexyl)-3-[1-(4-nitrophenyl)pyrrol-2-yl]acrylamide Formula: C21H22N4O3 MolecularWeight: 378.42438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C(=CC2=CC=CN2C3=CC=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

CC1CCCCC1NC(=O)/C(=C/C2=CC=CN2C3=CC=C(C=C3)[N+](=O)[O-])/C#N

InChI

InChI=1S/C21H22N4O3/c1-15-5-2-3-7-20(15)23-21(26)16(14-22)13-19-6-4-12-24(19)17-8-10-18(11-9-17)25(27)28/h4,6,8-13,15,20H,2-3,5,7H2,1H3,(H,23,26)/b16-13+