methyl 4-[2-[2-(5-cyclobutyl-3-oxidanyl-pentyl)-6-oxidanylidene-1,2-diazinan-1-yl]ethyl]benzoate

Systemtic Name: methyl 4-[2-[2-(5-cyclobutyl-3-oxidanyl-pentyl)-6-oxidanylidene-1,2-diazinan-1-yl]ethyl]benzoate Openeye Name: methyl 4-[2-[2-(5-cyclobutyl-3-hydroxy-pentyl)-6-oxo-hexahydropyridazin-1-yl]ethyl]benzoate CAS Name: 4-[2-[2-(5-cyclobutyl-3-hydroxypentyl)-6-oxo-1-diazinanyl]ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[2-(5-cyclobutyl-3-hydroxypentyl)-6-oxodiazinan-1-yl]ethyl]benzoate Traditional Name: 4-[2-[2-(5-cyclobutyl-3-hydroxy-pentyl)-6-keto-hexahydropyridazin-1-yl]ethyl]benzoic acid methyl ester Formula: C23H34N2O4 MolecularWeight: 402.52706

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CCN2C(=O)CCCN2CCC(CCC3CCC3)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CCN2C(=O)CCCN2CCC(CCC3CCC3)O

InChI

InChI=1S/C23H34N2O4/c1-29-23(28)20-10-7-19(8-11-20)13-17-25-22(27)6-3-15-24(25)16-14-21(26)12-9-18-4-2-5-18/h7-8,10-11,18,21,26H,2-6,9,12-17H2,1H3