4-[(7-fluoranyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)methylamino]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[(7-fluoranyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)methylamino]cyclohexane-1-carboxylic acid Openeye Name: 4-[(7-fluoro-3-oxo-4H-1,4-benzoxazin-6-yl)methylamino]cyclohexanecarboxylic acid CAS Name: 4-[(7-fluoro-3-oxo-4H-1,4-benzoxazin-6-yl)methylamino]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[(7-fluoro-3-oxo-4H-1,4-benzoxazin-6-yl)methylamino]cyclohexane-1-carboxylic acid Traditional Name: 4-[(7-fluoro-3-keto-4H-1,4-benzoxazin-6-yl)methylamino]cyclohexanecarboxylic acid Formula: C16H19FN2O4 MolecularWeight: 322.331463

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C(=O)O)NCC2=CC3=C(C=C2F)OCC(=O)N3

Isomeric SMILES

C1CC(CCC1C(=O)O)NCC2=CC3=C(C=C2F)OCC(=O)N3

InChI

InChI=1S/C16H19FN2O4/c17-12-6-14-13(19-15(20)8-23-14)5-10(12)7-18-11-3-1-9(2-4-11)16(21)22/h5-6,9,11,18H,1-4,7-8H2,(H,19,20)(H,21,22)