methyl 6-[(3S)-4,4-dimethyl-3-(3-methyl-1,2-oxazol-5-yl)-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl]-6-oxidanylidene-hexanoate

Systemtic Name: methyl 6-[(3S)-4,4-dimethyl-3-(3-methyl-1,2-oxazol-5-yl)-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl]-6-oxidanylidene-hexanoate Openeye Name: methyl 6-[(3S)-2-hydroxy-4,4-dimethyl-3-(3-methylisoxazol-5-yl)-6-oxo-cyclohexen-1-yl]-6-oxo-hexanoate CAS Name: 6-[(3S)-2-hydroxy-4,4-dimethyl-3-(3-methyl-5-isoxazolyl)-6-oxo-1-cyclohexenyl]-6-oxohexanoic acid methyl ester IUPAC Name: methyl 6-[(3S)-2-hydroxy-4,4-dimethyl-3-(3-methyl-1,2-oxazol-5-yl)-6-oxocyclohexen-1-yl]-6-oxohexanoate Traditional Name: 6-[(3S)-2-hydroxy-6-keto-4,4-dimethyl-3-(3-methylisoxazol-5-yl)cyclohexen-1-yl]-6-keto-hexanoic acid methyl ester Formula: C19H25NO6 MolecularWeight: 363.4049

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)C2C(=C(C(=O)CC2(C)C)C(=O)CCCCC(=O)OC)O

Isomeric SMILES

CC1=NOC(=C1)[C@@H]2C(=C(C(=O)CC2(C)C)C(=O)CCCCC(=O)OC)O

InChI

InChI=1S/C19H25NO6/c1-11-9-14(26-20-11)17-18(24)16(13(22)10-19(17,2)3)12(21)7-5-6-8-15(23)25-4/h9,17,24H,5-8,10H2,1-4H3/t17-/m1/s1