4-oxidanylidene-4-[3-oxidanylidene-4-(phenylmethyl)-1,4-benzoxazin-6-yl]butanoate

Systemtic Name: 4-oxidanylidene-4-[3-oxidanylidene-4-(phenylmethyl)-1,4-benzoxazin-6-yl]butanoate Openeye Name: 4-(4-benzyl-3-oxo-1,4-benzoxazin-6-yl)-4-oxo-butanoate CAS Name: 4-oxo-4-[3-oxo-4-(phenylmethyl)-1,4-benzoxazin-6-yl]butanoate IUPAC Name: 4-(4-benzyl-3-oxo-1,4-benzoxazin-6-yl)-4-oxobutanoate Traditional Name: 4-(4-benzyl-3-keto-1,4-benzoxazin-6-yl)-4-keto-butyrate Formula: C19H16NO5- MolecularWeight: 338.33404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(O1)C=CC(=C2)C(=O)CCC(=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

C1C(=O)N(C2=C(O1)C=CC(=C2)C(=O)CCC(=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C19H17NO5/c21-16(7-9-19(23)24)14-6-8-17-15(10-14)20(18(22)12-25-17)11-13-4-2-1-3-5-13/h1-6,8,10H,7,9,11-12H2,(H,23,24)/p-1