4-[[6-[(4-fluorophenyl)methylcarbamoyl]-4-oxidanylidene-2H-1,3-benzoxazin-3-yl]methyl]benzoic acid

Systemtic Name: 4-[[6-[(4-fluorophenyl)methylcarbamoyl]-4-oxidanylidene-2H-1,3-benzoxazin-3-yl]methyl]benzoic acid Openeye Name: 4-[[6-[(4-fluorophenyl)methylcarbamoyl]-4-oxo-2H-1,3-benzoxazin-3-yl]methyl]benzoic acid CAS Name: 4-[[6-[[(4-fluorophenyl)methylamino]-oxomethyl]-4-oxo-2H-1,3-benzoxazin-3-yl]methyl]benzoic acid IUPAC Name: 4-[[6-[(4-fluorophenyl)methylcarbamoyl]-4-oxo-2H-1,3-benzoxazin-3-yl]methyl]benzoic acid Traditional Name: 4-[[6-[(4-fluorobenzyl)carbamoyl]-4-keto-2H-1,3-benzoxazin-3-yl]methyl]benzoic acid Formula: C24H19FN2O5 MolecularWeight: 434.416463

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Descriptors Computed from Structure

Canonical SMILES:

C1N(C(=O)C2=C(O1)C=CC(=C2)C(=O)NCC3=CC=C(C=C3)F)CC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1N(C(=O)C2=C(O1)C=CC(=C2)C(=O)NCC3=CC=C(C=C3)F)CC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C24H19FN2O5/c25-19-8-3-15(4-9-19)12-26-22(28)18-7-10-21-20(11-18)23(29)27(14-32-21)13-16-1-5-17(6-2-16)24(30)31/h1-11H,12-14H2,(H,26,28)(H,30,31)