tert-butyl 1-[(1-bromanylnaphthalen-2-yl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: tert-butyl 1-[(1-bromanylnaphthalen-2-yl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: tert-butyl 1-[(1-bromo-2-naphthyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 1-[(1-bromo-2-naphthalenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[(1-bromonaphthalen-2-yl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 1-[(1-bromo-2-naphthyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid tert-butyl ester Formula: C27H30BrNO4 MolecularWeight: 512.4354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2=CC(=C(C=C2C1CC3=C(C4=CC=CC=C4C=C3)Br)OC)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2=CC(=C(C=C2C1CC3=C(C4=CC=CC=C4C=C3)Br)OC)OC

InChI

InChI=1S/C27H30BrNO4/c1-27(2,3)33-26(30)29-13-12-18-15-23(31-4)24(32-5)16-21(18)22(29)14-19-11-10-17-8-6-7-9-20(17)25(19)28/h6-11,15-16,22H,12-14H2,1-5H3