N,N-diethyl-2-[4-[(3-oxidanylidene-2-phenyl-5-propan-2-yl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-yl)carbonyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N,N-diethyl-2-[4-[(3-oxidanylidene-2-phenyl-5-propan-2-yl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-yl)carbonyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N,N-diethyl-2-[4-(5-isopropyl-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N,N-diethyl-2-[4-[oxo-(3-oxo-2-phenyl-5-propan-2-yl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-yl)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N,N-diethyl-2-[4-(3-oxo-2-phenyl-5-propan-2-yl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N,N-diethyl-2-[4-(5-isopropyl-3-keto-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carbonyl)piperazin-1-ium-1-yl]acetamide Formula: C26H36N6O3+2 MolecularWeight: 480.60244

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C[NH+]1CCN(CC1)C(=O)C2=C3C(=C[N+](=C2)C(C)C)C(=O)N(N3)C4=CC=CC=C4

Isomeric SMILES

CCN(CC)C(=O)C[NH+]1CCN(CC1)C(=O)C2=C3C(=C[N+](=C2)C(C)C)C(=O)N(N3)C4=CC=CC=C4

InChI

InChI=1S/C26H34N6O3/c1-5-29(6-2)23(33)18-28-12-14-30(15-13-28)25(34)21-16-31(19(3)4)17-22-24(21)27-32(26(22)35)20-10-8-7-9-11-20/h7-11,16-17,19H,5-6,12-15,18H2,1-4H3/p+2