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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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