(4aS,7R,8aS)-7-phenylmethoxy-5-(phenylmethoxymethyl)-2,4,4a,7,8,8a-hexahydro-1H-isoquinolin-3-one

Systemtic Name: (4aS,7R,8aS)-7-phenylmethoxy-5-(phenylmethoxymethyl)-2,4,4a,7,8,8a-hexahydro-1H-isoquinolin-3-one Openeye Name: (4aS,7R,8aS)-7-benzyloxy-5-(benzyloxymethyl)-2,4,4a,7,8,8a-hexahydro-1H-isoquinolin-3-one CAS Name: (4aS,7R,8aS)-7-phenylmethoxy-5-(phenylmethoxymethyl)-2,4,4a,7,8,8a-hexahydro-1H-isoquinolin-3-one IUPAC Name: (4aS,7R,8aS)-7-phenylmethoxy-5-(phenylmethoxymethyl)-2,4,4a,7,8,8a-hexahydro-1H-isoquinolin-3-one Traditional Name: (4aS,7R,8aS)-7-benzoxy-5-(benzoxymethyl)-2,4,4a,7,8,8a-hexahydro-1H-isoquinolin-3-one Formula: C24H27NO3 MolecularWeight: 377.47608

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CNC(=O)CC2C(=CC1OCC3=CC=CC=C3)COCC4=CC=CC=C4

Isomeric SMILES

C1[C@@H]2CNC(=O)C[C@@H]2C(=C[C@@H]1OCC3=CC=CC=C3)COCC4=CC=CC=C4

InChI

InChI=1S/C24H27NO3/c26-24-13-23-20(14-25-24)11-22(28-16-19-9-5-2-6-10-19)12-21(23)17-27-15-18-7-3-1-4-8-18/h1-10,12,20,22-23H,11,13-17H2,(H,25,26)/t20-,22-,23+/m1/s1