3-[[4-[bis(methylsulfonyl)amino]phenyl]amino]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[[4-[bis(methylsulfonyl)amino]phenyl]amino]-3-oxidanylidene-propanoic acid Openeye Name: 3-[4-[bis(methylsulfonyl)amino]anilino]-3-oxo-propanoic acid CAS Name: 3-[4-[bis(methylsulfonyl)amino]anilino]-3-oxopropanoic acid IUPAC Name: 3-[4-[bis(methylsulfonyl)amino]anilino]-3-oxopropanoic acid Traditional Name: 3-[4-(dimesylamino)anilino]-3-keto-propionic acid Formula: C11H14N2O7S2 MolecularWeight: 350.36806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N2O7S2/c1-21(17,18)13(22(2,19)20)9-5-3-8(4-6-9)12-10(14)7-11(15)16/h3-6H,7H2,1-2H3,(H,12,14)(H,15,16)