4-methyl-6-[2-oxidanylidene-2-(4-piperidin-1-ium-1-ylpiperidin-1-yl)ethyl]pyrimido[1,2-b]indazol-2-one

Systemtic Name: 4-methyl-6-[2-oxidanylidene-2-(4-piperidin-1-ium-1-ylpiperidin-1-yl)ethyl]pyrimido[1,2-b]indazol-2-one Openeye Name: 4-methyl-6-[2-oxo-2-(4-piperidin-1-ium-1-yl-1-piperidyl)ethyl]pyrimido[1,2-b]indazol-2-one CAS Name: 4-methyl-6-[2-oxo-2-[4-(1-piperidin-1-iumyl)-1-piperidinyl]ethyl]-2-pyrimido[1,2-b]indazolone IUPAC Name: 4-methyl-6-[2-oxo-2-(4-piperidin-1-ium-1-ylpiperidin-1-yl)ethyl]pyrimido[1,2-b]indazol-2-one Traditional Name: 6-[2-keto-2-(4-piperidin-1-ium-1-ylpiperidino)ethyl]-4-methyl-pyrimid[1,2-b]indazol-2-one Formula: C23H30N5O2+ MolecularWeight: 408.5166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C2N1N(C3=CC=CC=C32)CC(=O)N4CCC(CC4)[NH+]5CCCCC5

Isomeric SMILES

CC1=CC(=O)N=C2N1N(C3=CC=CC=C32)CC(=O)N4CCC(CC4)[NH+]5CCCCC5

InChI

InChI=1S/C23H29N5O2/c1-17-15-21(29)24-23-19-7-3-4-8-20(19)27(28(17)23)16-22(30)26-13-9-18(10-14-26)25-11-5-2-6-12-25/h3-4,7-8,15,18H,2,5-6,9-14,16H2,1H3/p+1