2-[[4-[5-(4-dimethylaminophenyl)-1,3-oxazol-2-yl]phenyl]sulfonylamino]butanedioic acid

Systemtic Name: 2-[[4-[5-(4-dimethylaminophenyl)-1,3-oxazol-2-yl]phenyl]sulfonylamino]butanedioic acid Openeye Name: 2-[[4-[5-(4-dimethylaminophenyl)oxazol-2-yl]phenyl]sulfonylamino]butanedioic acid CAS Name: 2-[[4-[5-(4-dimethylaminophenyl)-2-oxazolyl]phenyl]sulfonylamino]butanedioic acid IUPAC Name: 2-[[4-[5-(4-dimethylaminophenyl)-1,3-oxazol-2-yl]phenyl]sulfonylamino]butanedioic acid Traditional Name: 2-[[4-[5-(4-dimethylaminophenyl)oxazol-2-yl]phenyl]sulfonylamino]succinic acid Formula: C21H21N3O7S MolecularWeight: 459.47234

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=CN=C(O2)C3=CC=C(C=C3)S(=O)(=O)NC(CC(=O)O)C(=O)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=CN=C(O2)C3=CC=C(C=C3)S(=O)(=O)NC(CC(=O)O)C(=O)O

InChI

InChI=1S/C21H21N3O7S/c1-24(2)15-7-3-13(4-8-15)18-12-22-20(31-18)14-5-9-16(10-6-14)32(29,30)23-17(21(27)28)11-19(25)26/h3-10,12,17,23H,11H2,1-2H3,(H,25,26)(H,27,28)