cyanomethyl 4-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]benzoate

Systemtic Name: cyanomethyl 4-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]benzoate Openeye Name: cyanomethyl 4-(1,3-dioxobenzo[de]isoquinolin-2-yl)benzoate CAS Name: 4-(1,3-dioxo-2-benzo[de]isoquinolinyl)benzoic acid cyanomethyl ester IUPAC Name: cyanomethyl 4-(1,3-dioxobenzo[de]isoquinolin-2-yl)benzoate Traditional Name: 4-(1,3-diketobenzo[de]isoquinolin-2-yl)benzoic acid cyanomethyl ester Formula: C21H12N2O4 MolecularWeight: 356.33098

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C(=O)N(C(=O)C3=CC=C2)C4=CC=C(C=C4)C(=O)OCC#N

Isomeric SMILES

C1=CC2=C3C(=C1)C(=O)N(C(=O)C3=CC=C2)C4=CC=C(C=C4)C(=O)OCC#N

InChI

InChI=1S/C21H12N2O4/c22-11-12-27-21(26)14-7-9-15(10-8-14)23-19(24)16-5-1-3-13-4-2-6-17(18(13)16)20(23)25/h1-10H,12H2