6-(4-ethoxyphenyl)-2-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]pyridazin-3-one

Systemtic Name: 6-(4-ethoxyphenyl)-2-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]pyridazin-3-one Openeye Name: 2-[2-(4-benzyl-1-piperidyl)-2-oxo-ethyl]-6-(4-ethoxyphenyl)pyridazin-3-one CAS Name: 6-(4-ethoxyphenyl)-2-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-3-pyridazinone IUPAC Name: 2-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-6-(4-ethoxyphenyl)pyridazin-3-one Traditional Name: 2-[2-(4-benzylpiperidino)-2-keto-ethyl]-6-p-phenetyl-pyridazin-3-one Formula: C26H29N3O3 MolecularWeight: 431.52676

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H29N3O3/c1-2-32-23-10-8-22(9-11-23)24-12-13-25(30)29(27-24)19-26(31)28-16-14-21(15-17-28)18-20-6-4-3-5-7-20/h3-13,21H,2,14-19H2,1H3