4-chloranyl-5-(3-methylpiperidin-1-yl)-2-(phenylmethyl)pyridazin-3-one

Systemtic Name: 4-chloranyl-5-(3-methylpiperidin-1-yl)-2-(phenylmethyl)pyridazin-3-one Openeye Name: 2-benzyl-4-chloro-5-(3-methyl-1-piperidyl)pyridazin-3-one CAS Name: 4-chloro-5-(3-methyl-1-piperidinyl)-2-(phenylmethyl)-3-pyridazinone IUPAC Name: 2-benzyl-4-chloro-5-(3-methylpiperidin-1-yl)pyridazin-3-one Traditional Name: 2-benzyl-4-chloro-5-(3-methylpiperidino)pyridazin-3-one Formula: C17H20ClN3O MolecularWeight: 317.8132

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C(=O)N(N=C2)CC3=CC=CC=C3)Cl

Isomeric SMILES

CC1CCCN(C1)C2=C(C(=O)N(N=C2)CC3=CC=CC=C3)Cl

InChI

InChI=1S/C17H20ClN3O/c1-13-6-5-9-20(11-13)15-10-19-21(17(22)16(15)18)12-14-7-3-2-4-8-14/h2-4,7-8,10,13H,5-6,9,11-12H2,1H3