3-ethyl-N-(2-ethyl-1H-pyrazol-2-ium-3-yl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-ethyl-N-(2-ethyl-1H-pyrazol-2-ium-3-yl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-ethyl-N-(2-ethyl-1H-pyrazol-2-ium-3-yl)-4-oxo-phthalazine-1-carboxamide CAS Name: 3-ethyl-N-(2-ethyl-1H-pyrazol-2-ium-3-yl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-ethyl-N-(2-ethyl-1H-pyrazol-2-ium-3-yl)-4-oxophthalazine-1-carboxamide Traditional Name: 3-ethyl-N-(2-ethyl-1H-pyrazol-2-ium-3-yl)-4-keto-phthalazine-1-carboxamide Formula: C16H18N5O2+ MolecularWeight: 312.34642

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=[N+](NC=C3)CC

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=[N+](NC=C3)CC

InChI

InChI=1S/C16H17N5O2/c1-3-20-13(9-10-17-20)18-15(22)14-11-7-5-6-8-12(11)16(23)21(4-2)19-14/h5-10H,3-4H2,1-2H3,(H,17,18,22)/p+1