methyl (3R)-2-[2-(1-phenylcyclopentyl)carbonyloxyethanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: methyl (3R)-2-[2-(1-phenylcyclopentyl)carbonyloxyethanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: methyl (3R)-2-[2-(1-phenylcyclopentanecarbonyl)oxyacetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: (3R)-2-[1-oxo-2-[oxo-(1-phenylcyclopentyl)methoxy]ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl (3R)-2-[2-(1-phenylcyclopentanecarbonyl)oxyacetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: (3R)-2-[2-(1-phenylcyclopentanecarbonyl)oxyacetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester Formula: C25H27NO5 MolecularWeight: 421.48558

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC2=CC=CC=C2CN1C(=O)COC(=O)C3(CCCC3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)[C@H]1CC2=CC=CC=C2CN1C(=O)COC(=O)C3(CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C25H27NO5/c1-30-23(28)21-15-18-9-5-6-10-19(18)16-26(21)22(27)17-31-24(29)25(13-7-8-14-25)20-11-3-2-4-12-20/h2-6,9-12,21H,7-8,13-17H2,1H3/t21-/m1/s1