(2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl) 1-oxidanylidene-2H-isoquinoline-3-carboxylate

Systemtic Name: (2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl) 1-oxidanylidene-2H-isoquinoline-3-carboxylate Openeye Name: (2-morpholino-2-oxo-1-phenyl-ethyl) 1-oxo-2H-isoquinoline-3-carboxylate CAS Name: 1-oxo-2H-isoquinoline-3-carboxylic acid [2-(4-morpholinyl)-2-oxo-1-phenylethyl] ester IUPAC Name: (2-morpholin-4-yl-2-oxo-1-phenylethyl) 1-oxo-2H-isoquinoline-3-carboxylate Traditional Name: 1-keto-2H-isoquinoline-3-carboxylic acid (2-keto-2-morpholino-1-phenyl-ethyl) ester Formula: C22H20N2O5 MolecularWeight: 392.4046

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C(C2=CC=CC=C2)OC(=O)C3=CC4=CC=CC=C4C(=O)N3

Isomeric SMILES

C1COCCN1C(=O)C(C2=CC=CC=C2)OC(=O)C3=CC4=CC=CC=C4C(=O)N3

InChI

InChI=1S/C22H20N2O5/c25-20-17-9-5-4-8-16(17)14-18(23-20)22(27)29-19(15-6-2-1-3-7-15)21(26)24-10-12-28-13-11-24/h1-9,14,19H,10-13H2,(H,23,25)