propan-2-yl 4-[3-(3-oxidanylidene-4H-quinoxalin-2-yl)propanoylamino]benzoate

Systemtic Name: propan-2-yl 4-[3-(3-oxidanylidene-4H-quinoxalin-2-yl)propanoylamino]benzoate Openeye Name: isopropyl 4-[3-(3-oxo-4H-quinoxalin-2-yl)propanoylamino]benzoate CAS Name: 4-[[1-oxo-3-(3-oxo-4H-quinoxalin-2-yl)propyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[3-(3-oxo-4H-quinoxalin-2-yl)propanoylamino]benzoate Traditional Name: 4-[3-(3-keto-4H-quinoxalin-2-yl)propanoylamino]benzoic acid isopropyl ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CCC2=NC3=CC=CC=C3NC2=O

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CCC2=NC3=CC=CC=C3NC2=O

InChI

InChI=1S/C21H21N3O4/c1-13(2)28-21(27)14-7-9-15(10-8-14)22-19(25)12-11-18-20(26)24-17-6-4-3-5-16(17)23-18/h3-10,13H,11-12H2,1-2H3,(H,22,25)(H,24,26)