[1,3-benzodioxol-5-yl(isoquinolin-1-yl)methyl] benzoate

Systemtic Name: [1,3-benzodioxol-5-yl(isoquinolin-1-yl)methyl] benzoate Openeye Name: [1,3-benzodioxol-5-yl(1-isoquinolyl)methyl] benzoate CAS Name: benzoic acid [1,3-benzodioxol-5-yl(1-isoquinolinyl)methyl] ester IUPAC Name: [1,3-benzodioxol-5-yl(isoquinolin-1-yl)methyl] benzoate Traditional Name: benzoic acid [1,3-benzodioxol-5-yl(1-isoquinolyl)methyl] ester Formula: C24H17NO4 MolecularWeight: 383.39608

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(C3=NC=CC4=CC=CC=C43)OC(=O)C5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(C3=NC=CC4=CC=CC=C43)OC(=O)C5=CC=CC=C5

InChI

InChI=1S/C24H17NO4/c26-24(17-7-2-1-3-8-17)29-23(18-10-11-20-21(14-18)28-15-27-20)22-19-9-5-4-6-16(19)12-13-25-22/h1-14,23H,15H2