methyl 2-(4-bromophenyl)-2-(2,3-diphenyl-1H-isoquinolin-1-yl)-2-oxidanyl-ethanoate

Systemtic Name: methyl 2-(4-bromophenyl)-2-(2,3-diphenyl-1H-isoquinolin-1-yl)-2-oxidanyl-ethanoate Openeye Name: methyl 2-(4-bromophenyl)-2-(2,3-diphenyl-1H-isoquinolin-1-yl)-2-hydroxy-acetate CAS Name: 2-(4-bromophenyl)-2-(2,3-diphenyl-1H-isoquinolin-1-yl)-2-hydroxyacetic acid methyl ester IUPAC Name: methyl 2-(4-bromophenyl)-2-(2,3-diphenyl-1H-isoquinolin-1-yl)-2-hydroxyacetate Traditional Name: 2-(4-bromophenyl)-2-(2,3-diphenyl-1H-isoquinolin-1-yl)-2-hydroxy-acetic acid methyl ester Formula: C30H24BrNO3 MolecularWeight: 526.42046

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1C2=CC=CC=C2C=C(N1C3=CC=CC=C3)C4=CC=CC=C4)(C5=CC=C(C=C5)Br)O

Isomeric SMILES

COC(=O)C(C1C2=CC=CC=C2C=C(N1C3=CC=CC=C3)C4=CC=CC=C4)(C5=CC=C(C=C5)Br)O

InChI

InChI=1S/C30H24BrNO3/c1-35-29(33)30(34,23-16-18-24(31)19-17-23)28-26-15-9-8-12-22(26)20-27(21-10-4-2-5-11-21)32(28)25-13-6-3-7-14-25/h2-20,28,34H,1H3