2-[[2,4-bis(oxidanylidene)-1,5-dihydro-1,5-benzodiazepin-7-yl]sulfonyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[[2,4-bis(oxidanylidene)-1,5-dihydro-1,5-benzodiazepin-7-yl]sulfonyl-methyl-amino]ethanoic acid Openeye Name: 2-[(2,4-dioxo-1,5-dihydro-1,5-benzodiazepin-7-yl)sulfonyl-methyl-amino]acetic acid CAS Name: 2-[(2,4-dioxo-1,5-dihydro-1,5-benzodiazepin-7-yl)sulfonyl-methylamino]acetic acid IUPAC Name: 2-[(2,4-dioxo-1,5-dihydro-1,5-benzodiazepin-7-yl)sulfonyl-methylamino]acetic acid Traditional Name: 2-[(2,4-diketo-1,5-dihydro-1,5-benzodiazepin-7-yl)sulfonyl-methyl-amino]acetic acid Formula: C12H13N3O6S MolecularWeight: 327.31312

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)S(=O)(=O)C1=CC2=C(C=C1)NC(=O)CC(=O)N2

Isomeric SMILES

CN(CC(=O)O)S(=O)(=O)C1=CC2=C(C=C1)NC(=O)CC(=O)N2

InChI

InChI=1S/C12H13N3O6S/c1-15(6-12(18)19)22(20,21)7-2-3-8-9(4-7)14-11(17)5-10(16)13-8/h2-4H,5-6H2,1H3,(H,13,16)(H,14,17)(H,18,19)