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

Systemtic Name: phenacyl 4-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]benzoate Openeye Name: phenacyl 4-(1,3-dioxobenzo[de]isoquinolin-2-yl)benzoate CAS Name: 4-(1,3-dioxo-2-benzo[de]isoquinolinyl)benzoic acid phenacyl ester IUPAC Name: phenacyl 4-(1,3-dioxobenzo[de]isoquinolin-2-yl)benzoate Traditional Name: 4-(1,3-diketobenzo[de]isoquinolin-2-yl)benzoic acid phenacyl ester Formula: C27H17NO5 MolecularWeight: 435.42758

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC5=C4C(=CC=C5)C3=O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC5=C4C(=CC=C5)C3=O

InChI

InChI=1S/C27H17NO5/c29-23(17-6-2-1-3-7-17)16-33-27(32)19-12-14-20(15-13-19)28-25(30)21-10-4-8-18-9-5-11-22(24(18)21)26(28)31/h1-15H,16H2