2-[2-[2-[(2-hydroxyphenyl)carbonylamino]ethanoylamino]ethanoylamino]ethanoic acid; technetium-99

Systemtic Name: 2-[2-[2-[(2-hydroxyphenyl)carbonylamino]ethanoylamino]ethanoylamino]ethanoic acid; technetium-99 Openeye Name: 2-[[2-[[2-[(2-hydroxybenzoyl)amino]acetyl]amino]acetyl]amino]acetic acid; technetium-99 CAS Name: 2-[[2-[[2-[[(2-hydroxyphenyl)-oxomethyl]amino]-1-oxoethyl]amino]-1-oxoethyl]amino]acetic acid; technetium-99 IUPAC Name: 2-[[2-[[2-[(2-hydroxybenzoyl)amino]acetyl]amino]acetyl]amino]acetic acid; technetium-99 Traditional Name: 2-[[2-[[2-(salicyloylamino)acetyl]amino]acetyl]amino]acetic acid; technetium-99 Formula: C13H15N3O6Tc MolecularWeight: 408.180955

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NCC(=O)NCC(=O)NCC(=O)O)O.[Tc]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NCC(=O)NCC(=O)NCC(=O)O)O.[99Tc]

InChI

InChI=1S/C13H15N3O6.Tc/c17-9-4-2-1-3-8(9)13(22)16-6-11(19)14-5-10(18)15-7-12(20)21;/h1-4,17H,5-7H2,(H,14,19)(H,15,18)(H,16,22)(H,20,21);/i;1+1