methyl 2-[2-(4-bromophenyl)-3-phenyl-1H-isoquinolin-1-yl]-2-oxidanyl-2-phenyl-ethanoate

Systemtic Name: methyl 2-[2-(4-bromophenyl)-3-phenyl-1H-isoquinolin-1-yl]-2-oxidanyl-2-phenyl-ethanoate Openeye Name: methyl 2-[2-(4-bromophenyl)-3-phenyl-1H-isoquinolin-1-yl]-2-hydroxy-2-phenyl-acetate CAS Name: 2-[2-(4-bromophenyl)-3-phenyl-1H-isoquinolin-1-yl]-2-hydroxy-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-[2-(4-bromophenyl)-3-phenyl-1H-isoquinolin-1-yl]-2-hydroxy-2-phenylacetate Traditional Name: 2-[2-(4-bromophenyl)-3-phenyl-1H-isoquinolin-1-yl]-2-hydroxy-2-phenyl-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=C(C=C3)Br)C4=CC=CC=C4)(C5=CC=CC=C5)O

Isomeric SMILES

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

InChI

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