4-[[4-(carboxymethyl)-3-oxidanylidene-1,4-benzoxazin-6-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[4-(carboxymethyl)-3-oxidanylidene-1,4-benzoxazin-6-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[4-(carboxymethyl)-3-oxo-1,4-benzoxazin-6-yl]amino]-4-oxo-butanoic acid CAS Name: 4-[[4-(carboxymethyl)-3-oxo-1,4-benzoxazin-6-yl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[4-(carboxymethyl)-3-oxo-1,4-benzoxazin-6-yl]amino]-4-oxobutanoic acid Traditional Name: 4-[[4-(carboxymethyl)-3-keto-1,4-benzoxazin-6-yl]amino]-4-keto-butyric acid Formula: C14H14N2O7 MolecularWeight: 322.27016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(O1)C=CC(=C2)NC(=O)CCC(=O)O)CC(=O)O

Isomeric SMILES

C1C(=O)N(C2=C(O1)C=CC(=C2)NC(=O)CCC(=O)O)CC(=O)O

InChI

InChI=1S/C14H14N2O7/c17-11(3-4-13(19)20)15-8-1-2-10-9(5-8)16(6-14(21)22)12(18)7-23-10/h1-2,5H,3-4,6-7H2,(H,15,17)(H,19,20)(H,21,22)