[1-methyl-7-(phenylcarbonyloxy)isoquinolin-6-yl] benzoate

Systemtic Name: [1-methyl-7-(phenylcarbonyloxy)isoquinolin-6-yl] benzoate Openeye Name: (7-benzoyloxy-1-methyl-6-isoquinolyl) benzoate CAS Name: benzoic acid (7-benzoyloxy-1-methyl-6-isoquinolinyl) ester IUPAC Name: (7-benzoyloxy-1-methylisoquinolin-6-yl) benzoate Traditional Name: benzoic acid (7-benzoyloxy-1-methyl-6-isoquinolyl) ester Formula: C24H17NO4 MolecularWeight: 383.39608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC2=CC(=C(C=C12)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=NC=CC2=CC(=C(C=C12)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H17NO4/c1-16-20-15-22(29-24(27)18-10-6-3-7-11-18)21(14-19(20)12-13-25-16)28-23(26)17-8-4-2-5-9-17/h2-15H,1H3