2-(4-methyl-2-oxidanylidene-pyrimido[1,2-b]indazol-6-yl)-N-[2-(2-methylpiperidin-1-ium-1-yl)ethyl]ethanamide

Systemtic Name: 2-(4-methyl-2-oxidanylidene-pyrimido[1,2-b]indazol-6-yl)-N-[2-(2-methylpiperidin-1-ium-1-yl)ethyl]ethanamide Openeye Name: 2-(4-methyl-2-oxo-pyrimido[1,2-b]indazol-6-yl)-N-[2-(2-methylpiperidin-1-ium-1-yl)ethyl]acetamide CAS Name: 2-(4-methyl-2-oxo-6-pyrimido[1,2-b]indazolyl)-N-[2-(2-methyl-1-piperidin-1-iumyl)ethyl]acetamide IUPAC Name: 2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6-yl)-N-[2-(2-methylpiperidin-1-ium-1-yl)ethyl]acetamide Traditional Name: 2-(2-keto-4-methyl-pyrimid[1,2-b]indazol-6-yl)-N-[2-(2-methylpiperidin-1-ium-1-yl)ethyl]acetamide Formula: C21H28N5O2+ MolecularWeight: 382.47932

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCNC(=O)CN2C3=CC=CC=C3C4=NC(=O)C=C(N42)C

Isomeric SMILES

CC1CCCC[NH+]1CCNC(=O)CN2C3=CC=CC=C3C4=NC(=O)C=C(N42)C

InChI

InChI=1S/C21H27N5O2/c1-15-7-5-6-11-24(15)12-10-22-20(28)14-25-18-9-4-3-8-17(18)21-23-19(27)13-16(2)26(21)25/h3-4,8-9,13,15H,5-7,10-12,14H2,1-2H3,(H,22,28)/p+1