[4-[(4S)-4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl]phenyl] butanoate

Systemtic Name: [4-[(4S)-4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl]phenyl] butanoate Openeye Name: [4-[(4S)-4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl]phenyl] butanoate CAS Name: butanoic acid [4-[(4S)-4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl]phenyl] ester IUPAC Name: [4-[(4S)-4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl]phenyl] butanoate Traditional Name: butyric acid [4-[(4S)-6-keto-4-methyl-4,5-dihydro-1H-pyridazin-3-yl]phenyl] ester Formula: C15H18N2O3 MolecularWeight: 274.31502

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=CC=C(C=C1)C2=NNC(=O)CC2C

Isomeric SMILES

CCCC(=O)OC1=CC=C(C=C1)C2=NNC(=O)C[C@@H]2C

InChI

InChI=1S/C15H18N2O3/c1-3-4-14(19)20-12-7-5-11(6-8-12)15-10(2)9-13(18)16-17-15/h5-8,10H,3-4,9H2,1-2H3,(H,16,18)/t10-/m0/s1