ethyl 2-(anthracen-9-ylmethoxy)-2-(2,3-diphenyl-1H-isoquinolin-1-yl)ethanoate

Systemtic Name: ethyl 2-(anthracen-9-ylmethoxy)-2-(2,3-diphenyl-1H-isoquinolin-1-yl)ethanoate Openeye Name: ethyl 2-(9-anthrylmethoxy)-2-(2,3-diphenyl-1H-isoquinolin-1-yl)acetate CAS Name: 2-(9-anthracenylmethoxy)-2-(2,3-diphenyl-1H-isoquinolin-1-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-(anthracen-9-ylmethoxy)-2-(2,3-diphenyl-1H-isoquinolin-1-yl)acetate Traditional Name: 2-(9-anthrylmethoxy)-2-(2,3-diphenyl-1H-isoquinolin-1-yl)acetic acid ethyl ester Formula: C40H33NO3 MolecularWeight: 575.69492

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1C2=CC=CC=C2C=C(N1C3=CC=CC=C3)C4=CC=CC=C4)OCC5=C6C=CC=CC6=CC7=CC=CC=C75

Isomeric SMILES

CCOC(=O)C(C1C2=CC=CC=C2C=C(N1C3=CC=CC=C3)C4=CC=CC=C4)OCC5=C6C=CC=CC6=CC7=CC=CC=C75

InChI

InChI=1S/C40H33NO3/c1-2-43-40(42)39(44-27-36-33-22-12-9-17-29(33)25-30-18-10-13-23-34(30)36)38-35-24-14-11-19-31(35)26-37(28-15-5-3-6-16-28)41(38)32-20-7-4-8-21-32/h3-26,38-39H,2,27H2,1H3