6-[4-[2-(4-methylphenyl)ethyl]piperidin-1-yl]carbonyl-2-(2-phenoxyethyl)pyridazin-3-one

Systemtic Name: 6-[4-[2-(4-methylphenyl)ethyl]piperidin-1-yl]carbonyl-2-(2-phenoxyethyl)pyridazin-3-one Openeye Name: 2-(2-phenoxyethyl)-6-[4-[2-(p-tolyl)ethyl]piperidine-1-carbonyl]pyridazin-3-one CAS Name: 6-[[4-[2-(4-methylphenyl)ethyl]-1-piperidinyl]-oxomethyl]-2-(2-phenoxyethyl)-3-pyridazinone IUPAC Name: 6-[4-[2-(4-methylphenyl)ethyl]piperidine-1-carbonyl]-2-(2-phenoxyethyl)pyridazin-3-one Traditional Name: 2-(2-phenoxyethyl)-6-[4-[2-(p-tolyl)ethyl]piperidine-1-carbonyl]pyridazin-3-one Formula: C27H31N3O3 MolecularWeight: 445.55334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCC2CCN(CC2)C(=O)C3=NN(C(=O)C=C3)CCOC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CCC2CCN(CC2)C(=O)C3=NN(C(=O)C=C3)CCOC4=CC=CC=C4

InChI

InChI=1S/C27H31N3O3/c1-21-7-9-22(10-8-21)11-12-23-15-17-29(18-16-23)27(32)25-13-14-26(31)30(28-25)19-20-33-24-5-3-2-4-6-24/h2-10,13-14,23H,11-12,15-20H2,1H3