3-[(1-ethylbenzotriazol-5-yl)carbonylamino]propanoic acid

Systemtic Name: 3-[(1-ethylbenzotriazol-5-yl)carbonylamino]propanoic acid Openeye Name: 3-[(1-ethylbenzotriazole-5-carbonyl)amino]propanoic acid CAS Name: 3-[[(1-ethyl-5-benzotriazolyl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-[(1-ethylbenzotriazole-5-carbonyl)amino]propanoic acid Traditional Name: 3-[(1-ethylbenzotriazole-5-carbonyl)amino]propionic acid Formula: C12H14N4O3 MolecularWeight: 262.26456

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)NCCC(=O)O)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)NCCC(=O)O)N=N1

InChI

InChI=1S/C12H14N4O3/c1-2-16-10-4-3-8(7-9(10)14-15-16)12(19)13-6-5-11(17)18/h3-4,7H,2,5-6H2,1H3,(H,13,19)(H,17,18)