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

Systemtic Name: (C-isoquinolin-1-yl-N-naphthalen-1-yl-carbonimidoyl) benzoate Openeye Name: [C-(1-isoquinolyl)-N-(1-naphthyl)carbonimidoyl] benzoate CAS Name: benzoic acid [1-isoquinolinyl(1-naphthalenylimino)methyl] ester IUPAC Name: (C-isoquinolin-1-yl-N-naphthalen-1-ylcarbonimidoyl) benzoate Traditional Name: benzoic acid [C-(1-isoquinolyl)-N-(1-naphthyl)carbonimidoyl] ester Formula: C27H18N2O2 MolecularWeight: 402.44402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC(=NC2=CC=CC3=CC=CC=C32)C4=NC=CC5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC(=NC2=CC=CC3=CC=CC=C32)C4=NC=CC5=CC=CC=C54

InChI

InChI=1S/C27H18N2O2/c30-27(21-11-2-1-3-12-21)31-26(25-23-15-7-5-10-20(23)17-18-28-25)29-24-16-8-13-19-9-4-6-14-22(19)24/h1-18H