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

Systemtic Name: methyl 2-(2,3-diphenyl-1H-isoquinolin-1-yl)-2-(4-methoxyphenyl)-2-oxidanyl-ethanoate Openeye Name: methyl 2-(2,3-diphenyl-1H-isoquinolin-1-yl)-2-hydroxy-2-(4-methoxyphenyl)acetate CAS Name: 2-(2,3-diphenyl-1H-isoquinolin-1-yl)-2-hydroxy-2-(4-methoxyphenyl)acetic acid methyl ester IUPAC Name: methyl 2-(2,3-diphenyl-1H-isoquinolin-1-yl)-2-hydroxy-2-(4-methoxyphenyl)acetate Traditional Name: 2-(2,3-diphenyl-1H-isoquinolin-1-yl)-2-hydroxy-2-(4-methoxyphenyl)acetic acid methyl ester Formula: C31H27NO4 MolecularWeight: 477.55038

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2C3=CC=CC=C3C=C(N2C4=CC=CC=C4)C5=CC=CC=C5)(C(=O)OC)O

Isomeric SMILES

COC1=CC=C(C=C1)C(C2C3=CC=CC=C3C=C(N2C4=CC=CC=C4)C5=CC=CC=C5)(C(=O)OC)O

InChI

InChI=1S/C31H27NO4/c1-35-26-19-17-24(18-20-26)31(34,30(33)36-2)29-27-16-10-9-13-23(27)21-28(22-11-5-3-6-12-22)32(29)25-14-7-4-8-15-25/h3-21,29,34H,1-2H3