6-[4-[2-(3,5-dimethoxyphenyl)ethyl]piperidin-1-yl]carbonyl-2-phenyl-pyridazin-3-one

Systemtic Name: 6-[4-[2-(3,5-dimethoxyphenyl)ethyl]piperidin-1-yl]carbonyl-2-phenyl-pyridazin-3-one Openeye Name: 6-[4-[2-(3,5-dimethoxyphenyl)ethyl]piperidine-1-carbonyl]-2-phenyl-pyridazin-3-one CAS Name: 6-[[4-[2-(3,5-dimethoxyphenyl)ethyl]-1-piperidinyl]-oxomethyl]-2-phenyl-3-pyridazinone IUPAC Name: 6-[4-[2-(3,5-dimethoxyphenyl)ethyl]piperidine-1-carbonyl]-2-phenylpyridazin-3-one Traditional Name: 6-[4-[2-(3,5-dimethoxyphenyl)ethyl]piperidine-1-carbonyl]-2-phenyl-pyridazin-3-one Formula: C26H29N3O4 MolecularWeight: 447.52616

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CCC2CCN(CC2)C(=O)C3=NN(C(=O)C=C3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CCC2CCN(CC2)C(=O)C3=NN(C(=O)C=C3)C4=CC=CC=C4)OC

InChI

InChI=1S/C26H29N3O4/c1-32-22-16-20(17-23(18-22)33-2)9-8-19-12-14-28(15-13-19)26(31)24-10-11-25(30)29(27-24)21-6-4-3-5-7-21/h3-7,10-11,16-19H,8-9,12-15H2,1-2H3