tert-butyl 6-(2-methoxyethoxymethoxy)-1-(phenylmethoxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: tert-butyl 6-(2-methoxyethoxymethoxy)-1-(phenylmethoxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: tert-butyl 1-(benzyloxymethyl)-6-(2-methoxyethoxymethoxy)-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 6-(2-methoxyethoxymethoxy)-1-(phenylmethoxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-(2-methoxyethoxymethoxy)-1-(phenylmethoxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 1-(benzoxymethyl)-6-(2-methoxyethoxymethoxy)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid tert-butyl ester Formula: C26H35NO6 MolecularWeight: 457.5592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2=C(C1COCC3=CC=CC=C3)C=CC(=C2)OCOCCOC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2=C(C1COCC3=CC=CC=C3)C=CC(=C2)OCOCCOC

InChI

InChI=1S/C26H35NO6/c1-26(2,3)33-25(28)27-13-12-21-16-22(32-19-30-15-14-29-4)10-11-23(21)24(27)18-31-17-20-8-6-5-7-9-20/h5-11,16,24H,12-15,17-19H2,1-4H3