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

Systemtic Name: (E)-2-cyano-N-cyclopropyl-3-[2,5-dimethyl-1-(3-nitro-4-piperidin-1-yl-phenyl)pyrrol-3-yl]prop-2-enamide Openeye Name: (E)-2-cyano-N-cyclopropyl-3-[2,5-dimethyl-1-[3-nitro-4-(1-piperidyl)phenyl]pyrrol-3-yl]prop-2-enamide CAS Name: (E)-2-cyano-N-cyclopropyl-3-[2,5-dimethyl-1-[3-nitro-4-(1-piperidinyl)phenyl]-3-pyrrolyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-cyclopropyl-3-[2,5-dimethyl-1-(3-nitro-4-piperidin-1-ylphenyl)pyrrol-3-yl]prop-2-enamide Traditional Name: (E)-2-cyano-N-cyclopropyl-3-[2,5-dimethyl-1-(3-nitro-4-piperidino-phenyl)pyrrol-3-yl]acrylamide Formula: C24H27N5O3 MolecularWeight: 433.50288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-])C)C=C(C#N)C(=O)NC4CC4

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-])C)/C=C(\C#N)/C(=O)NC4CC4

InChI

InChI=1S/C24H27N5O3/c1-16-12-18(13-19(15-25)24(30)26-20-6-7-20)17(2)28(16)21-8-9-22(23(14-21)29(31)32)27-10-4-3-5-11-27/h8-9,12-14,20H,3-7,10-11H2,1-2H3,(H,26,30)/b19-13+