oxidanylidene-[2-[3-[2-(sulfocarbonylamino)propan-2-yl]phenyl]propan-2-ylamino]methanesulfonic acid

Systemtic Name: oxidanylidene-[2-[3-[2-(sulfocarbonylamino)propan-2-yl]phenyl]propan-2-ylamino]methanesulfonic acid Openeye Name: [[1-methyl-1-[3-[1-methyl-1-(sulfocarbonylamino)ethyl]phenyl]ethyl]amino]-oxo-methanesulfonic acid CAS Name: oxo-[2-[3-[2-[[oxo(sulfo)methyl]amino]propan-2-yl]phenyl]propan-2-ylamino]methanesulfonic acid IUPAC Name: oxo-[2-[3-[2-(sulfocarbonylamino)propan-2-yl]phenyl]propan-2-ylamino]methanesulfonic acid Traditional Name: keto-[[1-methyl-1-[3-[1-methyl-1-(sulfocarbonylamino)ethyl]phenyl]ethyl]amino]methanesulfonic acid Formula: C14H20N2O8S2 MolecularWeight: 408.4472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC(=CC=C1)C(C)(C)NC(=O)S(=O)(=O)O)NC(=O)S(=O)(=O)O

Isomeric SMILES

CC(C)(C1=CC(=CC=C1)C(C)(C)NC(=O)S(=O)(=O)O)NC(=O)S(=O)(=O)O

InChI

InChI=1S/C14H20N2O8S2/c1-13(2,15-11(17)25(19,20)21)9-6-5-7-10(8-9)14(3,4)16-12(18)26(22,23)24/h5-8H,1-4H3,(H,15,17)(H,16,18)(H,19,20,21)(H,22,23,24)