N-cyclopropyl-2-[4-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[4-(4-oxo-3H-phthalazine-1-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-cyclopropyl-2-[4-[oxo-(4-oxo-3H-phthalazin-1-yl)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-(4-oxo-3H-phthalazine-1-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-(4-keto-3H-phthalazine-1-carbonyl)piperazin-1-ium-1-yl]acetamide Formula: C18H22N5O3+ MolecularWeight: 356.39898

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C[NH+]2CCN(CC2)C(=O)C3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

C1CC1NC(=O)C[NH+]2CCN(CC2)C(=O)C3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C18H21N5O3/c24-15(19-12-5-6-12)11-22-7-9-23(10-8-22)18(26)16-13-3-1-2-4-14(13)17(25)21-20-16/h1-4,12H,5-11H2,(H,19,24)(H,21,25)/p+1