(3S)-7-methoxy-2-phenylmethoxycarbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

Systemtic Name: (3S)-7-methoxy-2-phenylmethoxycarbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Openeye Name: (3S)-2-benzyloxycarbonyl-7-methoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid CAS Name: (3S)-7-methoxy-2-phenylmethoxycarbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid IUPAC Name: (3S)-7-methoxy-2-phenylmethoxycarbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Traditional Name: (3S)-2-carbobenzoxy-7-methoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Formula: C19H19NO5 MolecularWeight: 341.35786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CC(N(C2)C(=O)OCC3=CC=CC=C3)C(=O)O)C=C1

Isomeric SMILES

COC1=CC2=C(C[C@H](N(C2)C(=O)OCC3=CC=CC=C3)C(=O)O)C=C1

InChI

InChI=1S/C19H19NO5/c1-24-16-8-7-14-10-17(18(21)22)20(11-15(14)9-16)19(23)25-12-13-5-3-2-4-6-13/h2-9,17H,10-12H2,1H3,(H,21,22)/t17-/m0/s1