2-[carboxymethyl-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]amino]ethanoic acid; technetium-99

Systemtic Name: 2-[carboxymethyl-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]amino]ethanoic acid; technetium-99 Openeye Name: 2-[carboxymethyl-[2-(2,6-dimethylanilino)-2-oxo-ethyl]amino]acetic acid; technetium-99 CAS Name: 2-[carboxymethyl-[2-(2,6-dimethylanilino)-2-oxoethyl]amino]acetic acid; technetium-99 IUPAC Name: 2-[carboxymethyl-[2-(2,6-dimethylanilino)-2-oxoethyl]amino]acetic acid; technetium-99 Traditional Name: 2-[carboxymethyl-[2-(2,6-dimethylanilino)-2-keto-ethyl]amino]acetic acid; technetium-99 Formula: C14H18N2O5Tc MolecularWeight: 393.209375

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CN(CC(=O)O)CC(=O)O.[Tc]

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN(CC(=O)O)CC(=O)O.[99Tc]

InChI

InChI=1S/C14H18N2O5.Tc/c1-9-4-3-5-10(2)14(9)15-11(17)6-16(7-12(18)19)8-13(20)21;/h3-5H,6-8H2,1-2H3,(H,15,17)(H,18,19)(H,20,21);/i;1+1