4-[1-[3-[5-chloranyl-2-fluoranyl-4-[(1-methylindol-3-yl)carbonylamino]phenyl]-2-oxidanylidene-propoxy]-1-pyrrolidin-1-yl-ethoxy]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[1-[3-[5-chloranyl-2-fluoranyl-4-[(1-methylindol-3-yl)carbonylamino]phenyl]-2-oxidanylidene-propoxy]-1-pyrrolidin-1-yl-ethoxy]cyclohexane-1-carboxylic acid Openeye Name: 4-[1-[3-[5-chloro-2-fluoro-4-[(1-methylindole-3-carbonyl)amino]phenyl]-2-oxo-propoxy]-1-pyrrolidin-1-yl-ethoxy]cyclohexanecarboxylic acid CAS Name: 4-[1-[3-[5-chloro-2-fluoro-4-[[(1-methyl-3-indolyl)-oxomethyl]amino]phenyl]-2-oxopropoxy]-1-(1-pyrrolidinyl)ethoxy]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[1-[3-[5-chloro-2-fluoro-4-[(1-methylindole-3-carbonyl)amino]phenyl]-2-oxopropoxy]-1-pyrrolidin-1-ylethoxy]cyclohexane-1-carboxylic acid Traditional Name: 4-[1-[3-[5-chloro-2-fluoro-4-[(1-methylindole-3-carbonyl)amino]phenyl]-2-keto-propoxy]-1-pyrrolidino-ethoxy]cyclohexanecarboxylic acid Formula: C32H37ClFN3O6 MolecularWeight: 614.104083

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Descriptors Computed from Structure

Canonical SMILES:

CC(N1CCCC1)(OCC(=O)CC2=CC(=C(C=C2F)NC(=O)C3=CN(C4=CC=CC=C43)C)Cl)OC5CCC(CC5)C(=O)O

Isomeric SMILES

CC(N1CCCC1)(OCC(=O)CC2=CC(=C(C=C2F)NC(=O)C3=CN(C4=CC=CC=C43)C)Cl)OC5CCC(CC5)C(=O)O

InChI

InChI=1S/C32H37ClFN3O6/c1-32(37-13-5-6-14-37,43-23-11-9-20(10-12-23)31(40)41)42-19-22(38)15-21-16-26(33)28(17-27(21)34)35-30(39)25-18-36(2)29-8-4-3-7-24(25)29/h3-4,7-8,16-18,20,23H,5-6,9-15,19H2,1-2H3,(H,35,39)(H,40,41)