(2-bromophenyl)-[1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methanone

Systemtic Name: (2-bromophenyl)-[1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methanone Openeye Name: (2-bromophenyl)-[1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methanone CAS Name: (2-bromophenyl)-[1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methanone IUPAC Name: (2-bromophenyl)-[1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methanone Traditional Name: (2-bromophenyl)-[1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methanone Formula: C31H36BrNO5 MolecularWeight: 582.52524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CC2C3=CC(=C(C=C3CCN2C(=O)C4=CC=CC=C4Br)OCC)OCC)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CC2C3=CC(=C(C=C3CCN2C(=O)C4=CC=CC=C4Br)OCC)OCC)OCC

InChI

InChI=1S/C31H36BrNO5/c1-5-35-27-14-13-21(18-28(27)36-6-2)17-26-24-20-30(38-8-4)29(37-7-3)19-22(24)15-16-33(26)31(34)23-11-9-10-12-25(23)32/h9-14,18-20,26H,5-8,15-17H2,1-4H3