4-azanyl-5-(azepan-1-yl)-2-phenyl-pyridazin-3-one hydrochloride

Systemtic Name: 4-azanyl-5-(azepan-1-yl)-2-phenyl-pyridazin-3-one hydrochloride Openeye Name: 4-amino-5-(azepan-1-yl)-2-phenyl-pyridazin-3-one hydrochloride CAS Name: 4-amino-5-(1-azepanyl)-2-phenyl-3-pyridazinone hydrochloride IUPAC Name: 4-amino-5-(azepan-1-yl)-2-phenylpyridazin-3-one hydrochloride Traditional Name: 4-amino-5-(azepan-1-yl)-2-phenyl-pyridazin-3-one hydrochloride Formula: C16H21ClN4O MolecularWeight: 320.81714

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C(=O)N(N=C2)C3=CC=CC=C3)N.Cl

Isomeric SMILES

C1CCCN(CC1)C2=C(C(=O)N(N=C2)C3=CC=CC=C3)N.Cl

InChI

InChI=1S/C16H20N4O.ClH/c17-15-14(19-10-6-1-2-7-11-19)12-18-20(16(15)21)13-8-4-3-5-9-13;/h3-5,8-9,12H,1-2,6-7,10-11,17H2;1H