methyl 1-[(2-bromophenyl)methyl]-6-methoxy-7-oxidanyl-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: methyl 1-[(2-bromophenyl)methyl]-6-methoxy-7-oxidanyl-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: methyl 1-[(2-bromophenyl)methyl]-7-hydroxy-6-methoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 1-[(2-bromophenyl)methyl]-7-hydroxy-6-methoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid methyl ester IUPAC Name: methyl 1-[(2-bromophenyl)methyl]-7-hydroxy-6-methoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 1-(2-bromobenzyl)-7-hydroxy-6-methoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid methyl ester Formula: C19H20BrNO4 MolecularWeight: 406.2704

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)OC)CC3=CC=CC=C3Br)O

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)C(=O)OC)CC3=CC=CC=C3Br)O

InChI

InChI=1S/C19H20BrNO4/c1-24-18-10-12-7-8-21(19(23)25-2)16(14(12)11-17(18)22)9-13-5-3-4-6-15(13)20/h3-6,10-11,16,22H,7-9H2,1-2H3