3-[1-methyl-2,5-bis(oxidanylidene)-3H-1,4-benzodiazepin-4-yl]propanoic acid

Systemtic Name: 3-[1-methyl-2,5-bis(oxidanylidene)-3H-1,4-benzodiazepin-4-yl]propanoic acid Openeye Name: 3-(1-methyl-2,5-dioxo-3H-1,4-benzodiazepin-4-yl)propanoic acid CAS Name: 3-(1-methyl-2,5-dioxo-3H-1,4-benzodiazepin-4-yl)propanoic acid IUPAC Name: 3-(1-methyl-2,5-dioxo-3H-1,4-benzodiazepin-4-yl)propanoic acid Traditional Name: 3-(2,5-diketo-1-methyl-3H-1,4-benzodiazepin-4-yl)propionic acid Formula: C13H14N2O4 MolecularWeight: 262.26126

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CN(C(=O)C2=CC=CC=C21)CCC(=O)O

Isomeric SMILES

CN1C(=O)CN(C(=O)C2=CC=CC=C21)CCC(=O)O

InChI

InChI=1S/C13H14N2O4/c1-14-10-5-3-2-4-9(10)13(19)15(8-11(14)16)7-6-12(17)18/h2-5H,6-8H2,1H3,(H,17,18)