N-[4-oxidanylidene-1-(pyridin-4-ylmethyl)-3H-phthalazin-6-yl]ethanamide hydrochloride

Systemtic Name: N-[4-oxidanylidene-1-(pyridin-4-ylmethyl)-3H-phthalazin-6-yl]ethanamide hydrochloride Openeye Name: N-[4-oxo-1-(4-pyridylmethyl)-3H-phthalazin-6-yl]acetamide hydrochloride CAS Name: N-[4-oxo-1-(pyridin-4-ylmethyl)-3H-phthalazin-6-yl]acetamide hydrochloride IUPAC Name: N-[4-oxo-1-(pyridin-4-ylmethyl)-3H-phthalazin-6-yl]acetamide hydrochloride Traditional Name: N-[4-keto-1-(4-pyridylmethyl)-3H-phthalazin-6-yl]acetamide hydrochloride Formula: C16H15ClN4O2 MolecularWeight: 330.7689

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)C(=NNC2=O)CC3=CC=NC=C3.Cl

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)C(=NNC2=O)CC3=CC=NC=C3.Cl

InChI

InChI=1S/C16H14N4O2.ClH/c1-10(21)18-12-2-3-13-14(9-12)16(22)20-19-15(13)8-11-4-6-17-7-5-11;/h2-7,9H,8H2,1H3,(H,18,21)(H,20,22);1H