4-chloranyl-5-[4-(3,5-dimethoxyphenyl)carbonylpiperazin-1-yl]-2-phenyl-pyridazin-3-one

Systemtic Name: 4-chloranyl-5-[4-(3,5-dimethoxyphenyl)carbonylpiperazin-1-yl]-2-phenyl-pyridazin-3-one Openeye Name: 4-chloro-5-[4-(3,5-dimethoxybenzoyl)piperazin-1-yl]-2-phenyl-pyridazin-3-one CAS Name: 4-chloro-5-[4-[(3,5-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]-2-phenyl-3-pyridazinone IUPAC Name: 4-chloro-5-[4-(3,5-dimethoxybenzoyl)piperazin-1-yl]-2-phenylpyridazin-3-one Traditional Name: 4-chloro-5-[4-(3,5-dimethoxybenzoyl)piperazino]-2-phenyl-pyridazin-3-one Formula: C23H23ClN4O4 MolecularWeight: 454.90612

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)N2CCN(CC2)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)Cl)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)N2CCN(CC2)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)Cl)OC

InChI

InChI=1S/C23H23ClN4O4/c1-31-18-12-16(13-19(14-18)32-2)22(29)27-10-8-26(9-11-27)20-15-25-28(23(30)21(20)24)17-6-4-3-5-7-17/h3-7,12-15H,8-11H2,1-2H3