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

Systemtic Name: methyl (3R)-2-[2-[4-(propan-2-yloxymethyl)phenyl]carbonyloxyethanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: methyl (3R)-2-[2-[4-(isopropoxymethyl)benzoyl]oxyacetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: (3R)-2-[1-oxo-2-[oxo-[4-(propan-2-yloxymethyl)phenyl]methoxy]ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl (3R)-2-[2-[4-(propan-2-yloxymethyl)benzoyl]oxyacetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: (3R)-2-[2-[4-(isopropoxymethyl)benzoyl]oxyacetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester Formula: C24H27NO6 MolecularWeight: 425.47428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCC1=CC=C(C=C1)C(=O)OCC(=O)N2CC3=CC=CC=C3CC2C(=O)OC

Isomeric SMILES

CC(C)OCC1=CC=C(C=C1)C(=O)OCC(=O)N2CC3=CC=CC=C3C[C@@H]2C(=O)OC

InChI

InChI=1S/C24H27NO6/c1-16(2)30-14-17-8-10-18(11-9-17)23(27)31-15-22(26)25-13-20-7-5-4-6-19(20)12-21(25)24(28)29-3/h4-11,16,21H,12-15H2,1-3H3/t21-/m1/s1