6,6-dimethoxy-1-oxidanylidene-2-(phenylmethyl)-4,4a,5,7,8,8a-hexahydro-3H-isoquinoline-3-carboxylate

Systemtic Name: 6,6-dimethoxy-1-oxidanylidene-2-(phenylmethyl)-4,4a,5,7,8,8a-hexahydro-3H-isoquinoline-3-carboxylate Openeye Name: 2-benzyl-6,6-dimethoxy-1-oxo-4,4a,5,7,8,8a-hexahydro-3H-isoquinoline-3-carboxylate CAS Name: 6,6-dimethoxy-1-oxo-2-(phenylmethyl)-4,4a,5,7,8,8a-hexahydro-3H-isoquinoline-3-carboxylate IUPAC Name: 2-benzyl-6,6-dimethoxy-1-oxo-4,4a,5,7,8,8a-hexahydro-3H-isoquinoline-3-carboxylate Traditional Name: 2-benzyl-1-keto-6,6-dimethoxy-4,4a,5,7,8,8a-hexahydro-3H-isoquinoline-3-carboxylate Formula: C19H24NO5- MolecularWeight: 346.39756

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Descriptors Computed from Structure

Canonical SMILES:

COC1(CCC2C(C1)CC(N(C2=O)CC3=CC=CC=C3)C(=O)[O-])OC

Isomeric SMILES

COC1(CCC2C(C1)CC(N(C2=O)CC3=CC=CC=C3)C(=O)[O-])OC

InChI

InChI=1S/C19H25NO5/c1-24-19(25-2)9-8-15-14(11-19)10-16(18(22)23)20(17(15)21)12-13-6-4-3-5-7-13/h3-7,14-16H,8-12H2,1-2H3,(H,22,23)/p-1