3-[3-[3-(4-tert-butylphenyl)carbonylpiperidin-1-yl]-3-oxidanylidene-propyl]-4,5-dihydro-1H-pyridazin-6-one

Systemtic Name: 3-[3-[3-(4-tert-butylphenyl)carbonylpiperidin-1-yl]-3-oxidanylidene-propyl]-4,5-dihydro-1H-pyridazin-6-one Openeye Name: 3-[3-[3-(4-tert-butylbenzoyl)-1-piperidyl]-3-oxo-propyl]-4,5-dihydro-1H-pyridazin-6-one CAS Name: 3-[3-[3-[(4-tert-butylphenyl)-oxomethyl]-1-piperidinyl]-3-oxopropyl]-4,5-dihydro-1H-pyridazin-6-one IUPAC Name: 3-[3-[3-(4-tert-butylbenzoyl)piperidin-1-yl]-3-oxopropyl]-4,5-dihydro-1H-pyridazin-6-one Traditional Name: 3-[3-[3-(4-tert-butylbenzoyl)piperidino]-3-keto-propyl]-4,5-dihydro-1H-pyridazin-6-one Formula: C23H31N3O3 MolecularWeight: 397.51054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)C2CCCN(C2)C(=O)CCC3=NNC(=O)CC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)C2CCCN(C2)C(=O)CCC3=NNC(=O)CC3

InChI

InChI=1S/C23H31N3O3/c1-23(2,3)18-8-6-16(7-9-18)22(29)17-5-4-14-26(15-17)21(28)13-11-19-10-12-20(27)25-24-19/h6-9,17H,4-5,10-15H2,1-3H3,(H,25,27)