4-[4-oxidanylidene-7-(propanoylamino)-3,1-benzoxazin-2-yl]benzoic acid

Systemtic Name: 4-[4-oxidanylidene-7-(propanoylamino)-3,1-benzoxazin-2-yl]benzoic acid Openeye Name: 4-[4-oxo-7-(propanoylamino)-3,1-benzoxazin-2-yl]benzoic acid CAS Name: 4-[4-oxo-7-(1-oxopropylamino)-3,1-benzoxazin-2-yl]benzoic acid IUPAC Name: 4-[4-oxo-7-(propanoylamino)-3,1-benzoxazin-2-yl]benzoic acid Traditional Name: 4-(4-keto-7-propionamido-3,1-benzoxazin-2-yl)benzoic acid Formula: C18H14N2O5 MolecularWeight: 338.31416

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC2=C(C=C1)C(=O)OC(=N2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCC(=O)NC1=CC2=C(C=C1)C(=O)OC(=N2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C18H14N2O5/c1-2-15(21)19-12-7-8-13-14(9-12)20-16(25-18(13)24)10-3-5-11(6-4-10)17(22)23/h3-9H,2H2,1H3,(H,19,21)(H,22,23)