4-[[4-methoxy-3-[methyl-(4-methylphenyl)sulfonyl-amino]phenyl]sulfonylamino]butanoate

Systemtic Name: 4-[[4-methoxy-3-[methyl-(4-methylphenyl)sulfonyl-amino]phenyl]sulfonylamino]butanoate Openeye Name: 4-[[4-methoxy-3-[methyl(p-tolylsulfonyl)amino]phenyl]sulfonylamino]butanoate CAS Name: 4-[[4-methoxy-3-[methyl-(4-methylphenyl)sulfonylamino]phenyl]sulfonylamino]butanoate IUPAC Name: 4-[[4-methoxy-3-[methyl-(4-methylphenyl)sulfonylamino]phenyl]sulfonylamino]butanoate Traditional Name: 4-[[4-methoxy-3-[methyl(tosyl)amino]phenyl]sulfonylamino]butyrate Formula: C19H23N2O7S2- MolecularWeight: 455.52512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=C(C=CC(=C2)S(=O)(=O)NCCCC(=O)[O-])OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=C(C=CC(=C2)S(=O)(=O)NCCCC(=O)[O-])OC

InChI

InChI=1S/C19H24N2O7S2/c1-14-6-8-15(9-7-14)30(26,27)21(2)17-13-16(10-11-18(17)28-3)29(24,25)20-12-4-5-19(22)23/h6-11,13,20H,4-5,12H2,1-3H3,(H,22,23)/p-1