N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-2-(1-oxidanylideneisoquinolin-2-yl)ethanamide

Systemtic Name: N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-2-(1-oxidanylideneisoquinolin-2-yl)ethanamide Openeye Name: N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-2-(1-oxo-2-isoquinolyl)acetamide CAS Name: N-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]-2-(1-oxo-2-isoquinolinyl)acetamide IUPAC Name: N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]-2-(1-oxoisoquinolin-2-yl)acetamide Traditional Name: 2-(1-keto-2-isoquinolyl)-N-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]acetamide Formula: C18H23N4O3+ MolecularWeight: 343.40022

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CNC(=O)CN2C=CC3=CC=CC=C3C2=O

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CNC(=O)CN2C=CC3=CC=CC=C3C2=O

InChI

InChI=1S/C18H22N4O3/c1-20-8-10-21(11-9-20)17(24)12-19-16(23)13-22-7-6-14-4-2-3-5-15(14)18(22)25/h2-7H,8-13H2,1H3,(H,19,23)/p+1