2-[[(7-methyl-2H-1,4-benzoxazin-3-yl)amino]methylidene]propanedioic acid

Systemtic Name: 2-[[(7-methyl-2H-1,4-benzoxazin-3-yl)amino]methylidene]propanedioic acid Openeye Name: 2-[[(7-methyl-2H-1,4-benzoxazin-3-yl)amino]methylene]propanedioic acid CAS Name: 2-[[(7-methyl-2H-1,4-benzoxazin-3-yl)amino]methylidene]propanedioic acid IUPAC Name: 2-[[(7-methyl-2H-1,4-benzoxazin-3-yl)amino]methylidene]propanedioic acid Traditional Name: 2-[[(7-methyl-2H-1,4-benzoxazin-3-yl)amino]methylene]malonic acid Formula: C13H12N2O5 MolecularWeight: 276.24478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(CO2)NC=C(C(=O)O)C(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(CO2)NC=C(C(=O)O)C(=O)O

InChI

InChI=1S/C13H12N2O5/c1-7-2-3-9-10(4-7)20-6-11(15-9)14-5-8(12(16)17)13(18)19/h2-5H,6H2,1H3,(H,14,15)(H,16,17)(H,18,19)