tert-butyl 2-[(1R)-2-[(1R)-2-oxidanyl-1-phenyl-ethyl]-3,4-dihydro-1H-isoquinolin-1-yl]ethanoate

Systemtic Name: tert-butyl 2-[(1R)-2-[(1R)-2-oxidanyl-1-phenyl-ethyl]-3,4-dihydro-1H-isoquinolin-1-yl]ethanoate Openeye Name: tert-butyl 2-[(1R)-2-[(1R)-2-hydroxy-1-phenyl-ethyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetate CAS Name: 2-[(1R)-2-[(1R)-2-hydroxy-1-phenylethyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(1R)-2-[(1R)-2-hydroxy-1-phenylethyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetate Traditional Name: 2-[(1R)-2-[(1R)-2-hydroxy-1-phenyl-ethyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid tert-butyl ester Formula: C23H29NO3 MolecularWeight: 367.48126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC1C2=CC=CC=C2CCN1C(CO)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)C[C@@H]1C2=CC=CC=C2CCN1[C@@H](CO)C3=CC=CC=C3

InChI

InChI=1S/C23H29NO3/c1-23(2,3)27-22(26)15-20-19-12-8-7-9-17(19)13-14-24(20)21(16-25)18-10-5-4-6-11-18/h4-12,20-21,25H,13-16H2,1-3H3/t20-,21+/m1/s1