4-oxidanylidene-5-[[(2R)-piperidin-1-ium-2-yl]carbonylamino]-3H-phthalazin-1-olate

Systemtic Name: 4-oxidanylidene-5-[[(2R)-piperidin-1-ium-2-yl]carbonylamino]-3H-phthalazin-1-olate Openeye Name: 4-oxo-5-[[(2R)-piperidin-1-ium-2-carbonyl]amino]-3H-phthalazin-1-olate CAS Name: 4-oxo-5-[[oxo-[(2R)-2-piperidin-1-iumyl]methyl]amino]-3H-phthalazin-1-olate IUPAC Name: 4-oxo-5-[[(2R)-piperidin-1-ium-2-carbonyl]amino]-3H-phthalazin-1-olate Traditional Name: 4-keto-5-[[(2R)-piperidin-1-ium-2-carbonyl]amino]-3H-phthalazin-1-olate Formula: C14H16N4O3 MolecularWeight: 288.30184

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH2+]C(C1)C(=O)NC2=CC=CC3=C2C(=O)NN=C3[O-]

Isomeric SMILES

C1CC[NH2+][C@H](C1)C(=O)NC2=CC=CC3=C2C(=O)NN=C3[O-]

InChI

InChI=1S/C14H16N4O3/c19-12-8-4-3-6-9(11(8)14(21)18-17-12)16-13(20)10-5-1-2-7-15-10/h3-4,6,10,15H,1-2,5,7H2,(H,16,20)(H,17,19)(H,18,21)/t10-/m1/s1