7-[4-[(2,5-dimethylphenyl)methyl]piperazin-1-yl]carbonyl-2-phenyl-5-propan-2-yl-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one

Systemtic Name: 7-[4-[(2,5-dimethylphenyl)methyl]piperazin-1-yl]carbonyl-2-phenyl-5-propan-2-yl-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one Openeye Name: 7-[4-[(2,5-dimethylphenyl)methyl]piperazine-1-carbonyl]-5-isopropyl-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one CAS Name: 7-[[4-[(2,5-dimethylphenyl)methyl]-1-piperazinyl]-oxomethyl]-2-phenyl-5-propan-2-yl-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one IUPAC Name: 7-[4-[(2,5-dimethylphenyl)methyl]piperazine-1-carbonyl]-2-phenyl-5-propan-2-yl-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one Traditional Name: 7-[4-(2,5-dimethylbenzyl)piperazine-1-carbonyl]-5-isopropyl-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one Formula: C29H34N5O2+ MolecularWeight: 484.61256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CN2CCN(CC2)C(=O)C3=C4C(=C[N+](=C3)C(C)C)C(=O)N(N4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=C(C=C1)C)CN2CCN(CC2)C(=O)C3=C4C(=C[N+](=C3)C(C)C)C(=O)N(N4)C5=CC=CC=C5

InChI

InChI=1S/C29H33N5O2/c1-20(2)33-18-25(27-26(19-33)29(36)34(30-27)24-8-6-5-7-9-24)28(35)32-14-12-31(13-15-32)17-23-16-21(3)10-11-22(23)4/h5-11,16,18-20H,12-15,17H2,1-4H3/p+1