1,5-dimethyl-4-[[5-(3-nitro-4-piperidin-1-yl-phenyl)furan-2-yl]methylideneamino]-2-phenyl-pyrazol-3-one

Systemtic Name: 1,5-dimethyl-4-[[5-(3-nitro-4-piperidin-1-yl-phenyl)furan-2-yl]methylideneamino]-2-phenyl-pyrazol-3-one Openeye Name: 1,5-dimethyl-4-[[5-[3-nitro-4-(1-piperidyl)phenyl]-2-furyl]methyleneamino]-2-phenyl-pyrazol-3-one CAS Name: 1,5-dimethyl-4-[[5-[3-nitro-4-(1-piperidinyl)phenyl]-2-furanyl]methylideneamino]-2-phenyl-3-pyrazolone IUPAC Name: 1,5-dimethyl-4-[[5-(3-nitro-4-piperidin-1-ylphenyl)furan-2-yl]methylideneamino]-2-phenylpyrazol-3-one Traditional Name: 1,5-dimethyl-4-[[5-(3-nitro-4-piperidino-phenyl)-2-furyl]methyleneamino]-2-phenyl-3-pyrazolin-3-one Formula: C27H27N5O4 MolecularWeight: 485.53438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=CC=C(O3)C4=CC(=C(C=C4)N5CCCCC5)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=CC=C(O3)C4=CC(=C(C=C4)N5CCCCC5)[N+](=O)[O-]

InChI

InChI=1S/C27H27N5O4/c1-19-26(27(33)31(29(19)2)21-9-5-3-6-10-21)28-18-22-12-14-25(36-22)20-11-13-23(24(17-20)32(34)35)30-15-7-4-8-16-30/h3,5-6,9-14,17-18H,4,7-8,15-16H2,1-2H3