[7-acetyloxy-2-ethanoyl-1-(phenylmethyl)-3,4-dihydro-1H-isoquinolin-6-yl] ethanoate

Systemtic Name: [7-acetyloxy-2-ethanoyl-1-(phenylmethyl)-3,4-dihydro-1H-isoquinolin-6-yl] ethanoate Openeye Name: (7-acetoxy-2-acetyl-1-benzyl-3,4-dihydro-1H-isoquinolin-6-yl) acetate CAS Name: acetic acid [2-acetyl-7-acetyloxy-1-(phenylmethyl)-3,4-dihydro-1H-isoquinolin-6-yl] ester IUPAC Name: (2-acetyl-7-acetyloxy-1-benzyl-3,4-dihydro-1H-isoquinolin-6-yl) acetate Traditional Name: acetic acid (7-acetoxy-2-acetyl-1-benzyl-3,4-dihydro-1H-isoquinolin-6-yl) ester Formula: C22H23NO5 MolecularWeight: 381.42172

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=CC(=C(C=C2C1CC3=CC=CC=C3)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)N1CCC2=CC(=C(C=C2C1CC3=CC=CC=C3)OC(=O)C)OC(=O)C

InChI

InChI=1S/C22H23NO5/c1-14(24)23-10-9-18-12-21(27-15(2)25)22(28-16(3)26)13-19(18)20(23)11-17-7-5-4-6-8-17/h4-8,12-13,20H,9-11H2,1-3H3