(C-isoquinolin-1-yl-N-phenyl-carbonimidoyl) benzoate

Systemtic Name: (C-isoquinolin-1-yl-N-phenyl-carbonimidoyl) benzoate Openeye Name: [C-(1-isoquinolyl)-N-phenyl-carbonimidoyl] benzoate CAS Name: benzoic acid [1-isoquinolinyl(phenylimino)methyl] ester IUPAC Name: (C-isoquinolin-1-yl-N-phenylcarbonimidoyl) benzoate Traditional Name: benzoic acid [C-(1-isoquinolyl)-N-phenyl-carbonimidoyl] ester Formula: C23H16N2O2 MolecularWeight: 352.38534

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC(=NC2=CC=CC=C2)C3=NC=CC4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC(=NC2=CC=CC=C2)C3=NC=CC4=CC=CC=C43

InChI

InChI=1S/C23H16N2O2/c26-23(18-10-3-1-4-11-18)27-22(25-19-12-5-2-6-13-19)21-20-14-8-7-9-17(20)15-16-24-21/h1-16H