O2-methyl O8a-(phenylmethyl) (4aS,8aR)-6-methyl-1-oxidanylidene-4,4a,5,8-tetrahydro-3H-isoquinoline-2,8a-dicarboxylate

Systemtic Name: O2-methyl O8a-(phenylmethyl) (4aS,8aR)-6-methyl-1-oxidanylidene-4,4a,5,8-tetrahydro-3H-isoquinoline-2,8a-dicarboxylate Openeye Name: O8a-benzyl O2-methyl (4aS,8aR)-6-methyl-1-oxo-4,4a,5,8-tetrahydro-3H-isoquinoline-2,8a-dicarboxylate CAS Name: (4aS,8aR)-6-methyl-1-oxo-4,4a,5,8-tetrahydro-3H-isoquinoline-2,8a-dicarboxylic acid O2-methyl ester O8a-(phenylmethyl) ester IUPAC Name: 8a-O-benzyl 2-O-methyl (4aS,8aR)-6-methyl-1-oxo-4,4a,5,8-tetrahydro-3H-isoquinoline-2,8a-dicarboxylate Traditional Name: (4aS,8aR)-1-keto-6-methyl-4,4a,5,8-tetrahydro-3H-isoquinoline-2,8a-dicarboxylic acid O8a-benzyl ester O2-methyl ester Formula: C20H23NO5 MolecularWeight: 357.40032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC2(C(C1)CCN(C2=O)C(=O)OC)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC[C@]2([C@@H](C1)CCN(C2=O)C(=O)OC)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H23NO5/c1-14-8-10-20(18(23)26-13-15-6-4-3-5-7-15)16(12-14)9-11-21(17(20)22)19(24)25-2/h3-8,16H,9-13H2,1-2H3/t16-,20-/m1/s1