3-[4-[2-(4-ethoxyphenyl)ethyl]piperidin-1-yl]carbonyl-6-methyl-1-phenyl-pyridazin-4-one

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CCC2CCN(CC2)C(=O)C3=NN(C(=CC3=O)C)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)CCC2CCN(CC2)C(=O)C3=NN(C(=CC3=O)C)C4=CC=CC=C4

InChI

InChI=1S/C27H31N3O3/c1-3-33-24-13-11-21(12-14-24)9-10-22-15-17-29(18-16-22)27(32)26-25(31)19-20(2)30(28-26)23-7-5-4-6-8-23/h4-8,11-14,19,22H,3,9-10,15-18H2,1-2H3