ethyl 2-[2-(4-methoxyphenyl)-3-phenyl-1H-isoquinolin-1-yl]-2-oxidanyl-ethanoate

Systemtic Name: ethyl 2-[2-(4-methoxyphenyl)-3-phenyl-1H-isoquinolin-1-yl]-2-oxidanyl-ethanoate Openeye Name: ethyl 2-hydroxy-2-[2-(4-methoxyphenyl)-3-phenyl-1H-isoquinolin-1-yl]acetate CAS Name: 2-hydroxy-2-[2-(4-methoxyphenyl)-3-phenyl-1H-isoquinolin-1-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-hydroxy-2-[2-(4-methoxyphenyl)-3-phenyl-1H-isoquinolin-1-yl]acetate Traditional Name: 2-hydroxy-2-[2-(4-methoxyphenyl)-3-phenyl-1H-isoquinolin-1-yl]acetic acid ethyl ester Formula: C26H25NO4 MolecularWeight: 415.481

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1C2=CC=CC=C2C=C(N1C3=CC=C(C=C3)OC)C4=CC=CC=C4)O

Isomeric SMILES

CCOC(=O)C(C1C2=CC=CC=C2C=C(N1C3=CC=C(C=C3)OC)C4=CC=CC=C4)O

InChI

InChI=1S/C26H25NO4/c1-3-31-26(29)25(28)24-22-12-8-7-11-19(22)17-23(18-9-5-4-6-10-18)27(24)20-13-15-21(30-2)16-14-20/h4-17,24-25,28H,3H2,1-2H3