4,5-dimethoxy-2-[[4-methyl-2-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonylamino]pentanoyl]amino]benzoic acid

Systemtic Name: 4,5-dimethoxy-2-[[4-methyl-2-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonylamino]pentanoyl]amino]benzoic acid Openeye Name: 4,5-dimethoxy-2-[[4-methyl-2-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonylamino]pentanoyl]amino]benzoic acid CAS Name: 4,5-dimethoxy-2-[[4-methyl-2-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonylamino]-1-oxopentyl]amino]benzoic acid IUPAC Name: 4,5-dimethoxy-2-[[4-methyl-2-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonylamino]pentanoyl]amino]benzoic acid Traditional Name: 2-[[2-[(2-keto-3-methyl-1,3-benzoxazol-6-yl)sulfonylamino]-4-methyl-pentanoyl]amino]-4,5-dimethoxy-benzoic acid Formula: C23H27N3O9S MolecularWeight: 521.54018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1=CC(=C(C=C1C(=O)O)OC)OC)NS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)C

Isomeric SMILES

CC(C)CC(C(=O)NC1=CC(=C(C=C1C(=O)O)OC)OC)NS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)C

InChI

InChI=1S/C23H27N3O9S/c1-12(2)8-16(21(27)24-15-11-20(34-5)19(33-4)10-14(15)22(28)29)25-36(31,32)13-6-7-17-18(9-13)35-23(30)26(17)3/h6-7,9-12,16,25H,8H2,1-5H3,(H,24,27)(H,28,29)