2-[2-(6-carboxy-7-chloranyl-4-oxidanylidene-3,1-benzoxazin-2-yl)propyl]-7-chloranyl-4-oxidanylidene-3,1-benzoxazine-6-carboxylic acid

Systemtic Name: 2-[2-(6-carboxy-7-chloranyl-4-oxidanylidene-3,1-benzoxazin-2-yl)propyl]-7-chloranyl-4-oxidanylidene-3,1-benzoxazine-6-carboxylic acid Openeye Name: 2-[2-(6-carboxy-7-chloro-4-oxo-3,1-benzoxazin-2-yl)propyl]-7-chloro-4-oxo-3,1-benzoxazine-6-carboxylic acid CAS Name: 2-[2-(6-carboxy-7-chloro-4-oxo-3,1-benzoxazin-2-yl)propyl]-7-chloro-4-oxo-3,1-benzoxazine-6-carboxylic acid IUPAC Name: 2-[2-(6-carboxy-7-chloro-4-oxo-3,1-benzoxazin-2-yl)propyl]-7-chloro-4-oxo-3,1-benzoxazine-6-carboxylic acid Traditional Name: 2-[2-(6-carboxy-7-chloro-4-keto-3,1-benzoxazin-2-yl)propyl]-7-chloro-4-keto-3,1-benzoxazine-6-carboxylic acid Formula: C21H12Cl2N2O8 MolecularWeight: 491.23458

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=NC2=CC(=C(C=C2C(=O)O1)C(=O)O)Cl)C3=NC4=CC(=C(C=C4C(=O)O3)C(=O)O)Cl

Isomeric SMILES

CC(CC1=NC2=CC(=C(C=C2C(=O)O1)C(=O)O)Cl)C3=NC4=CC(=C(C=C4C(=O)O3)C(=O)O)Cl

InChI

InChI=1S/C21H12Cl2N2O8/c1-7(17-25-15-6-13(23)9(19(28)29)4-11(15)21(31)33-17)2-16-24-14-5-12(22)8(18(26)27)3-10(14)20(30)32-16/h3-7H,2H2,1H3,(H,26,27)(H,28,29)