2-[methyl-(1-propan-2-ylbenzotriazol-5-yl)sulfonyl-amino]ethanoic acid

Systemtic Name: 2-[methyl-(1-propan-2-ylbenzotriazol-5-yl)sulfonyl-amino]ethanoic acid Openeye Name: 2-[(1-isopropylbenzotriazol-5-yl)sulfonyl-methyl-amino]acetic acid CAS Name: 2-[methyl-[(1-propan-2-yl-5-benzotriazolyl)sulfonyl]amino]acetic acid IUPAC Name: 2-[methyl-(1-propan-2-ylbenzotriazol-5-yl)sulfonylamino]acetic acid Traditional Name: 2-[(1-isopropylbenzotriazol-5-yl)sulfonyl-methyl-amino]acetic acid Formula: C12H16N4O4S MolecularWeight: 312.34484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=C(C=C2)S(=O)(=O)N(C)CC(=O)O)N=N1

Isomeric SMILES

CC(C)N1C2=C(C=C(C=C2)S(=O)(=O)N(C)CC(=O)O)N=N1

InChI

InChI=1S/C12H16N4O4S/c1-8(2)16-11-5-4-9(6-10(11)13-14-16)21(19,20)15(3)7-12(17)18/h4-6,8H,7H2,1-3H3,(H,17,18)