methyl (4aR,8aR)-2,6,7-trimethyl-1-oxidanylidene-4a,5,8,8a-tetrahydroisoquinoline-3-carboxylate

Systemtic Name: methyl (4aR,8aR)-2,6,7-trimethyl-1-oxidanylidene-4a,5,8,8a-tetrahydroisoquinoline-3-carboxylate Openeye Name: methyl (4aR,8aR)-2,6,7-trimethyl-1-oxo-4a,5,8,8a-tetrahydroisoquinoline-3-carboxylate CAS Name: (4aR,8aR)-2,6,7-trimethyl-1-oxo-4a,5,8,8a-tetrahydroisoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl (4aR,8aR)-2,6,7-trimethyl-1-oxo-4a,5,8,8a-tetrahydroisoquinoline-3-carboxylate Traditional Name: (4aR,8aR)-1-keto-2,6,7-trimethyl-4a,5,8,8a-tetrahydroisoquinoline-3-carboxylic acid methyl ester Formula: C14H19NO3 MolecularWeight: 249.30556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC2C(C1)C=C(N(C2=O)C)C(=O)OC)C

Isomeric SMILES

CC1=C(C[C@@H]2[C@H](C1)C=C(N(C2=O)C)C(=O)OC)C

InChI

InChI=1S/C14H19NO3/c1-8-5-10-7-12(14(17)18-4)15(3)13(16)11(10)6-9(8)2/h7,10-11H,5-6H2,1-4H3/t10-,11-/m1/s1