2-[2-[(6-methyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)sulfonylamino]ethanoylamino]ethanoic acid

Systemtic Name: 2-[2-[(6-methyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)sulfonylamino]ethanoylamino]ethanoic acid Openeye Name: 2-[[2-[(6-methyl-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonylamino]acetyl]amino]acetic acid CAS Name: 2-[[2-[(6-methyl-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonylamino]-1-oxoethyl]amino]acetic acid IUPAC Name: 2-[[2-[(6-methyl-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonylamino]acetyl]amino]acetic acid Traditional Name: 2-[[2-[(3-keto-6-methyl-4H-1,4-benzoxazin-7-yl)sulfonylamino]acetyl]amino]acetic acid Formula: C13H15N3O7S MolecularWeight: 357.3391

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1S(=O)(=O)NCC(=O)NCC(=O)O)OCC(=O)N2

Isomeric SMILES

CC1=CC2=C(C=C1S(=O)(=O)NCC(=O)NCC(=O)O)OCC(=O)N2

InChI

InChI=1S/C13H15N3O7S/c1-7-2-8-9(23-6-12(18)16-8)3-10(7)24(21,22)15-4-11(17)14-5-13(19)20/h2-3,15H,4-6H2,1H3,(H,14,17)(H,16,18)(H,19,20)