(2-oxidanylidene-9b-phenyl-4,5-dihydro-1H-azeto[2,1-a]isoquinolin-1-yl) 2-phenoxyethanoate

Systemtic Name: (2-oxidanylidene-9b-phenyl-4,5-dihydro-1H-azeto[2,1-a]isoquinolin-1-yl) 2-phenoxyethanoate Openeye Name: (2-oxo-9b-phenyl-4,5-dihydro-1H-azeto[2,1-a]isoquinolin-1-yl) 2-phenoxyacetate CAS Name: 2-phenoxyacetic acid (2-oxo-9b-phenyl-4,5-dihydro-1H-azeto[2,1-a]isoquinolin-1-yl) ester IUPAC Name: (2-oxo-9b-phenyl-4,5-dihydro-1H-azeto[2,1-a]isoquinolin-1-yl) 2-phenoxyacetate Traditional Name: 2-phenoxyacetic acid (2-keto-9b-phenyl-4,5-dihydro-1H-azet[2,1-a]isoquinolin-1-yl) ester Formula: C25H21NO4 MolecularWeight: 399.43854

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2C(=O)C(C2(C3=CC=CC=C31)C4=CC=CC=C4)OC(=O)COC5=CC=CC=C5

Isomeric SMILES

C1CN2C(=O)C(C2(C3=CC=CC=C31)C4=CC=CC=C4)OC(=O)COC5=CC=CC=C5

InChI

InChI=1S/C25H21NO4/c27-22(17-29-20-12-5-2-6-13-20)30-23-24(28)26-16-15-18-9-7-8-14-21(18)25(23,26)19-10-3-1-4-11-19/h1-14,23H,15-17H2