4-[3-[2-[(2-methylphenyl)amino]-1,3-benzoxazol-6-yl]-1-oxidanyl-2-oxidanylidene-1-pyrrolidin-1-yl-propoxy]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[3-[2-[(2-methylphenyl)amino]-1,3-benzoxazol-6-yl]-1-oxidanyl-2-oxidanylidene-1-pyrrolidin-1-yl-propoxy]cyclohexane-1-carboxylic acid Openeye Name: 4-[1-hydroxy-3-[2-(2-methylanilino)-1,3-benzoxazol-6-yl]-2-oxo-1-pyrrolidin-1-yl-propoxy]cyclohexanecarboxylic acid CAS Name: 4-[1-hydroxy-3-[2-(2-methylanilino)-1,3-benzoxazol-6-yl]-2-oxo-1-(1-pyrrolidinyl)propoxy]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[1-hydroxy-3-[2-(2-methylanilino)-1,3-benzoxazol-6-yl]-2-oxo-1-pyrrolidin-1-ylpropoxy]cyclohexane-1-carboxylic acid Traditional Name: 4-[1-hydroxy-2-keto-3-[2-(o-toluidino)-1,3-benzoxazol-6-yl]-1-pyrrolidino-propoxy]cyclohexanecarboxylic acid Formula: C28H33N3O6 MolecularWeight: 507.57812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC3=C(O2)C=C(C=C3)CC(=O)C(N4CCCC4)(O)OC5CCC(CC5)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1NC2=NC3=C(O2)C=C(C=C3)CC(=O)C(N4CCCC4)(O)OC5CCC(CC5)C(=O)O

InChI

InChI=1S/C28H33N3O6/c1-18-6-2-3-7-22(18)29-27-30-23-13-8-19(16-24(23)36-27)17-25(32)28(35,31-14-4-5-15-31)37-21-11-9-20(10-12-21)26(33)34/h2-3,6-8,13,16,20-21,35H,4-5,9-12,14-15,17H2,1H3,(H,29,30)(H,33,34)