3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-1-(2-methoxyethyl)-3-piperidin-4-yl-piperazine-2,5-dione hydrochloride

Systemtic Name: 3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-1-(2-methoxyethyl)-3-piperidin-4-yl-piperazine-2,5-dione hydrochloride Openeye Name: 3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-1-(2-methoxyethyl)-3-(4-piperidyl)piperazine-2,5-dione hydrochloride CAS Name: 3-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-1-(2-methoxyethyl)-3-(4-piperidinyl)piperazine-2,5-dione hydrochloride IUPAC Name: 3-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-1-(2-methoxyethyl)-3-piperidin-4-ylpiperazine-2,5-dione hydrochloride Traditional Name: 3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-1-(2-methoxyethyl)-3-(4-piperidyl)piperazine-2,5-quinone hydrochloride Formula: C24H34ClN5O3 MolecularWeight: 476.01146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CC3(C(=O)N(CC(=O)N3)CCOC)C4CCNCC4.Cl

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CC3(C(=O)N(CC(=O)N3)CCOC)C4CCNCC4.Cl

InChI

InChI=1S/C24H33N5O3.ClH/c1-17-21(18(2)29(27-17)20-7-5-4-6-8-20)15-24(19-9-11-25-12-10-19)23(31)28(13-14-32-3)16-22(30)26-24;/h4-8,19,25H,9-16H2,1-3H3,(H,26,30);1H