4,5-bis(chloranyl)-2-[4-(3-methylpiperidin-1-yl)carbonylphenyl]pyridazin-3-one

Systemtic Name: 4,5-bis(chloranyl)-2-[4-(3-methylpiperidin-1-yl)carbonylphenyl]pyridazin-3-one Openeye Name: 4,5-dichloro-2-[4-(3-methylpiperidine-1-carbonyl)phenyl]pyridazin-3-one CAS Name: 4,5-dichloro-2-[4-[(3-methyl-1-piperidinyl)-oxomethyl]phenyl]-3-pyridazinone IUPAC Name: 4,5-dichloro-2-[4-(3-methylpiperidine-1-carbonyl)phenyl]pyridazin-3-one Traditional Name: 4,5-dichloro-2-[4-(3-methylpiperidine-1-carbonyl)phenyl]pyridazin-3-one Formula: C17H17Cl2N3O2 MolecularWeight: 366.24178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C2=CC=C(C=C2)N3C(=O)C(=C(C=N3)Cl)Cl

Isomeric SMILES

CC1CCCN(C1)C(=O)C2=CC=C(C=C2)N3C(=O)C(=C(C=N3)Cl)Cl

InChI

InChI=1S/C17H17Cl2N3O2/c1-11-3-2-8-21(10-11)16(23)12-4-6-13(7-5-12)22-17(24)15(19)14(18)9-20-22/h4-7,9,11H,2-3,8,10H2,1H3