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

Systemtic Name: (E)-2-cyano-N-cyclopropyl-3-[2,5-dimethyl-1-(4-morpholin-4-yl-3-nitro-phenyl)pyrrol-3-yl]prop-2-enamide Openeye Name: (E)-2-cyano-N-cyclopropyl-3-[2,5-dimethyl-1-(4-morpholino-3-nitro-phenyl)pyrrol-3-yl]prop-2-enamide CAS Name: (E)-2-cyano-N-cyclopropyl-3-[2,5-dimethyl-1-[4-(4-morpholinyl)-3-nitrophenyl]-3-pyrrolyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-cyclopropyl-3-[2,5-dimethyl-1-(4-morpholin-4-yl-3-nitrophenyl)pyrrol-3-yl]prop-2-enamide Traditional Name: (E)-2-cyano-N-cyclopropyl-3-[2,5-dimethyl-1-(4-morpholino-3-nitro-phenyl)pyrrol-3-yl]acrylamide Formula: C23H25N5O4 MolecularWeight: 435.4757

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-])C)C=C(C#N)C(=O)NC4CC4

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-])C)/C=C(\C#N)/C(=O)NC4CC4

InChI

InChI=1S/C23H25N5O4/c1-15-11-17(12-18(14-24)23(29)25-19-3-4-19)16(2)27(15)20-5-6-21(22(13-20)28(30)31)26-7-9-32-10-8-26/h5-6,11-13,19H,3-4,7-10H2,1-2H3,(H,25,29)/b18-12+