[1-[(3-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate

Systemtic Name: [1-[(3-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate Openeye Name: [2-(3-fluoroanilino)-1-methyl-2-oxo-ethyl] 3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)propanoate CAS Name: 3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)propanoic acid [1-(3-fluoroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3-fluoroanilino)-1-oxopropan-2-yl] 3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)propanoate Traditional Name: 3-(3-keto-2-methyl-1,4-benzoxazin-4-yl)propionic acid [2-(3-fluoroanilino)-2-keto-1-methyl-ethyl] ester Formula: C21H21FN2O5 MolecularWeight: 400.400243

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=CC=CC=C2O1)CCC(=O)OC(C)C(=O)NC3=CC(=CC=C3)F

Isomeric SMILES

CC1C(=O)N(C2=CC=CC=C2O1)CCC(=O)OC(C)C(=O)NC3=CC(=CC=C3)F

InChI

InChI=1S/C21H21FN2O5/c1-13(20(26)23-16-7-5-6-15(22)12-16)29-19(25)10-11-24-17-8-3-4-9-18(17)28-14(2)21(24)27/h3-9,12-14H,10-11H2,1-2H3,(H,23,26)