1-(5-phenyl-3,4-dihydropyrazol-2-yl)-4-(4-piperidin-1-ylcarbonylpiperazin-1-yl)butane-1,4-dione

Systemtic Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-4-(4-piperidin-1-ylcarbonylpiperazin-1-yl)butane-1,4-dione Openeye Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-4-[4-(piperidine-1-carbonyl)piperazin-1-yl]butane-1,4-dione CAS Name: 1-[4-[oxo(1-piperidinyl)methyl]-1-piperazinyl]-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butane-1,4-dione IUPAC Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-4-[4-(piperidine-1-carbonyl)piperazin-1-yl]butane-1,4-dione Traditional Name: 1-(3-phenyl-2-pyrazolin-1-yl)-4-[4-(piperidine-1-carbonyl)piperazino]butane-1,4-dione Formula: C23H31N5O3 MolecularWeight: 425.52394

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)N2CCN(CC2)C(=O)CCC(=O)N3CCC(=N3)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C(=O)N2CCN(CC2)C(=O)CCC(=O)N3CCC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C23H31N5O3/c29-21(25-15-17-27(18-16-25)23(31)26-12-5-2-6-13-26)9-10-22(30)28-14-11-20(24-28)19-7-3-1-4-8-19/h1,3-4,7-8H,2,5-6,9-18H2