[5-bromanyl-1-[(2-bromanyl-5-methoxy-phenyl)methyl]-2-propyl-3,4-dihydro-1H-isoquinolin-8-yl] benzoate

Systemtic Name: [5-bromanyl-1-[(2-bromanyl-5-methoxy-phenyl)methyl]-2-propyl-3,4-dihydro-1H-isoquinolin-8-yl] benzoate Openeye Name: [5-bromo-1-[(2-bromo-5-methoxy-phenyl)methyl]-2-propyl-3,4-dihydro-1H-isoquinolin-8-yl] benzoate CAS Name: benzoic acid [5-bromo-1-[(2-bromo-5-methoxyphenyl)methyl]-2-propyl-3,4-dihydro-1H-isoquinolin-8-yl] ester IUPAC Name: [5-bromo-1-[(2-bromo-5-methoxyphenyl)methyl]-2-propyl-3,4-dihydro-1H-isoquinolin-8-yl] benzoate Traditional Name: benzoic acid [5-bromo-1-(2-bromo-5-methoxy-benzyl)-2-propyl-3,4-dihydro-1H-isoquinolin-8-yl] ester Formula: C27H27Br2NO3 MolecularWeight: 573.31618

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC2=C(C=CC(=C2C1CC3=C(C=CC(=C3)OC)Br)OC(=O)C4=CC=CC=C4)Br

Isomeric SMILES

CCCN1CCC2=C(C=CC(=C2C1CC3=C(C=CC(=C3)OC)Br)OC(=O)C4=CC=CC=C4)Br

InChI

InChI=1S/C27H27Br2NO3/c1-3-14-30-15-13-21-23(29)11-12-25(33-27(31)18-7-5-4-6-8-18)26(21)24(30)17-19-16-20(32-2)9-10-22(19)28/h4-12,16,24H,3,13-15,17H2,1-2H3