methyl (4aS,8aR)-7-methoxy-2-methyl-1-oxidanylidene-8,8a-dihydro-5H-isoquinoline-4a-carboxylate

Systemtic Name: methyl (4aS,8aR)-7-methoxy-2-methyl-1-oxidanylidene-8,8a-dihydro-5H-isoquinoline-4a-carboxylate Openeye Name: methyl (4aS,8aR)-7-methoxy-2-methyl-1-oxo-8,8a-dihydro-5H-isoquinoline-4a-carboxylate CAS Name: (4aS,8aR)-7-methoxy-2-methyl-1-oxo-8,8a-dihydro-5H-isoquinoline-4a-carboxylic acid methyl ester IUPAC Name: methyl (4aS,8aR)-7-methoxy-2-methyl-1-oxo-8,8a-dihydro-5H-isoquinoline-4a-carboxylate Traditional Name: (4aS,8aR)-1-keto-7-methoxy-2-methyl-8,8a-dihydro-5H-isoquinoline-4a-carboxylic acid methyl ester Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2(CC=C(CC2C1=O)OC)C(=O)OC

Isomeric SMILES

CN1C=C[C@]2(CC=C(C[C@H]2C1=O)OC)C(=O)OC

InChI

InChI=1S/C13H17NO4/c1-14-7-6-13(12(16)18-3)5-4-9(17-2)8-10(13)11(14)15/h4,6-7,10H,5,8H2,1-3H3/t10-,13-/m0/s1