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

Systemtic Name: 3-[(1-ethylbenzotriazol-5-yl)carbonylamino]butanoic acid Openeye Name: 3-[(1-ethylbenzotriazole-5-carbonyl)amino]butanoic acid CAS Name: 3-[[(1-ethyl-5-benzotriazolyl)-oxomethyl]amino]butanoic acid IUPAC Name: 3-[(1-ethylbenzotriazole-5-carbonyl)amino]butanoic acid Traditional Name: 3-[(1-ethylbenzotriazole-5-carbonyl)amino]butyric acid Formula: C13H16N4O3 MolecularWeight: 276.29114

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)NC(C)CC(=O)O)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)NC(C)CC(=O)O)N=N1

InChI

InChI=1S/C13H16N4O3/c1-3-17-11-5-4-9(7-10(11)15-16-17)13(20)14-8(2)6-12(18)19/h4-5,7-8H,3,6H2,1-2H3,(H,14,20)(H,18,19)