4-[(2S)-1-[(4-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl]-3-oxidanylidene-1,4-benzoxazine-7-carboxylic acid

Systemtic Name: 4-[(2S)-1-[(4-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl]-3-oxidanylidene-1,4-benzoxazine-7-carboxylic acid Openeye Name: 4-[(1S)-2-(4-fluoroanilino)-1-methyl-2-oxo-ethyl]-3-oxo-1,4-benzoxazine-7-carboxylic acid CAS Name: 4-[(2S)-1-(4-fluoroanilino)-1-oxopropan-2-yl]-3-oxo-1,4-benzoxazine-7-carboxylic acid IUPAC Name: 4-[(2S)-1-(4-fluoroanilino)-1-oxopropan-2-yl]-3-oxo-1,4-benzoxazine-7-carboxylic acid Traditional Name: 4-[(1S)-2-(4-fluoroanilino)-2-keto-1-methyl-ethyl]-3-keto-1,4-benzoxazine-7-carboxylic acid Formula: C18H15FN2O5 MolecularWeight: 358.320503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)F)N2C(=O)COC3=C2C=CC(=C3)C(=O)O

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)F)N2C(=O)COC3=C2C=CC(=C3)C(=O)O

InChI

InChI=1S/C18H15FN2O5/c1-10(17(23)20-13-5-3-12(19)4-6-13)21-14-7-2-11(18(24)25)8-15(14)26-9-16(21)22/h2-8,10H,9H2,1H3,(H,20,23)(H,24,25)/t10-/m0/s1