2-(3-methyl-1-oxidanylidene-isoquinolin-2-yl)-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]ethanamide

Systemtic Name: 2-(3-methyl-1-oxidanylidene-isoquinolin-2-yl)-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]ethanamide Openeye Name: 2-(3-methyl-1-oxo-2-isoquinolyl)-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]acetamide CAS Name: 2-(3-methyl-1-oxo-2-isoquinolinyl)-N-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]acetamide IUPAC Name: 2-(3-methyl-1-oxoisoquinolin-2-yl)-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]acetamide Traditional Name: 2-(1-keto-3-methyl-2-isoquinolyl)-N-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]acetamide Formula: C19H25N4O3+ MolecularWeight: 357.4268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC=C2C(=O)N1CC(=O)NCC(=O)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC2=CC=CC=C2C(=O)N1CC(=O)NCC(=O)N3CC[NH+](CC3)C

InChI

InChI=1S/C19H24N4O3/c1-14-11-15-5-3-4-6-16(15)19(26)23(14)13-17(24)20-12-18(25)22-9-7-21(2)8-10-22/h3-6,11H,7-10,12-13H2,1-2H3,(H,20,24)/p+1