2-methoxycarbonyl-6-(3-oxidanylidene-1,2-oxazol-5-yl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-3-carboxylic acid

Systemtic Name: 2-methoxycarbonyl-6-(3-oxidanylidene-1,2-oxazol-5-yl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-3-carboxylic acid Openeye Name: 2-methoxycarbonyl-6-(3-oxoisoxazol-5-yl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-3-carboxylic acid CAS Name: 2-methoxycarbonyl-6-(3-oxo-5-isoxazolyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-3-carboxylic acid IUPAC Name: 2-methoxycarbonyl-6-(3-oxo-1,2-oxazol-5-yl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-3-carboxylic acid Traditional Name: 2-carbomethoxy-6-(3-keto-4-isoxazolin-5-yl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-3-carboxylic acid Formula: C15H20N2O6 MolecularWeight: 324.3291

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CC2CCC(CC2CC1C(=O)O)C3=CC(=O)NO3

Isomeric SMILES

COC(=O)N1CC2CCC(CC2CC1C(=O)O)C3=CC(=O)NO3

InChI

InChI=1S/C15H20N2O6/c1-22-15(21)17-7-9-3-2-8(12-6-13(18)16-23-12)4-10(9)5-11(17)14(19)20/h6,8-11H,2-5,7H2,1H3,(H,16,18)(H,19,20)