(5-ethanoyl-2-methoxy-phenyl)methyl 2-[(1R)-2-ethanoyl-1H-isoquinolin-1-yl]ethanoate

Systemtic Name: (5-ethanoyl-2-methoxy-phenyl)methyl 2-[(1R)-2-ethanoyl-1H-isoquinolin-1-yl]ethanoate Openeye Name: (5-acetyl-2-methoxy-phenyl)methyl 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]acetate CAS Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]acetic acid (5-acetyl-2-methoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-methoxyphenyl)methyl 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]acetate Traditional Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]acetic acid (5-acetyl-2-methoxy-benzyl) ester Formula: C23H23NO5 MolecularWeight: 393.43242

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)COC(=O)CC2C3=CC=CC=C3C=CN2C(=O)C

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)COC(=O)C[C@@H]2C3=CC=CC=C3C=CN2C(=O)C

InChI

InChI=1S/C23H23NO5/c1-15(25)18-8-9-22(28-3)19(12-18)14-29-23(27)13-21-20-7-5-4-6-17(20)10-11-24(21)16(2)26/h4-12,21H,13-14H2,1-3H3/t21-/m1/s1