4-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-3-oxidanylidene-1,4-benzoxazine-7-carboxylic acid

Systemtic Name: 4-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-3-oxidanylidene-1,4-benzoxazine-7-carboxylic acid Openeye Name: 4-[2-(2-furylmethylamino)-2-oxo-ethyl]-3-oxo-1,4-benzoxazine-7-carboxylic acid CAS Name: 4-[2-(2-furanylmethylamino)-2-oxoethyl]-3-oxo-1,4-benzoxazine-7-carboxylic acid IUPAC Name: 4-[2-(furan-2-ylmethylamino)-2-oxoethyl]-3-oxo-1,4-benzoxazine-7-carboxylic acid Traditional Name: 4-[2-(2-furfurylamino)-2-keto-ethyl]-3-keto-1,4-benzoxazine-7-carboxylic acid Formula: C16H14N2O6 MolecularWeight: 330.29216

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(O1)C=C(C=C2)C(=O)O)CC(=O)NCC3=CC=CO3

Isomeric SMILES

C1C(=O)N(C2=C(O1)C=C(C=C2)C(=O)O)CC(=O)NCC3=CC=CO3

InChI

InChI=1S/C16H14N2O6/c19-14(17-7-11-2-1-5-23-11)8-18-12-4-3-10(16(21)22)6-13(12)24-9-15(18)20/h1-6H,7-9H2,(H,17,19)(H,21,22)