N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-4-(3,5-dimethylpiperidin-1-yl)-3-nitro-benzamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-4-(3,5-dimethylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-4-(3,5-dimethyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-4-(3,5-dimethyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-(3,5-dimethylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: 4-(3,5-dimethylpiperidino)-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-3-nitro-benzamide Formula: C25H29N5O4 MolecularWeight: 463.52886

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C2=C(C=C(C=C2)C(=O)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C)[N+](=O)[O-])C

Isomeric SMILES

CC1CC(CN(C1)C2=C(C=C(C=C2)C(=O)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C)[N+](=O)[O-])C

InChI

InChI=1S/C25H29N5O4/c1-16-12-17(2)15-28(14-16)21-11-10-19(13-22(21)30(33)34)24(31)26-23-18(3)27(4)29(25(23)32)20-8-6-5-7-9-20/h5-11,13,16-17H,12,14-15H2,1-4H3,(H,26,31)