4-[4-[7-fluoranyl-2-(1-methylindol-3-yl)-1,3-benzoxazol-6-yl]-1-methoxy-3-oxidanylidene-2-pyrrolidin-1-yl-butan-2-yl]oxycyclohexane-1-carboxylic acid

Systemtic Name: 4-[4-[7-fluoranyl-2-(1-methylindol-3-yl)-1,3-benzoxazol-6-yl]-1-methoxy-3-oxidanylidene-2-pyrrolidin-1-yl-butan-2-yl]oxycyclohexane-1-carboxylic acid Openeye Name: 4-[3-[7-fluoro-2-(1-methylindol-3-yl)-1,3-benzoxazol-6-yl]-1-(methoxymethyl)-2-oxo-1-pyrrolidin-1-yl-propoxy]cyclohexanecarboxylic acid CAS Name: 4-[4-[7-fluoro-2-(1-methyl-3-indolyl)-1,3-benzoxazol-6-yl]-1-methoxy-3-oxo-2-(1-pyrrolidinyl)butan-2-yl]oxy-1-cyclohexanecarboxylic acid IUPAC Name: 4-[4-[7-fluoro-2-(1-methylindol-3-yl)-1,3-benzoxazol-6-yl]-1-methoxy-3-oxo-2-pyrrolidin-1-ylbutan-2-yl]oxycyclohexane-1-carboxylic acid Traditional Name: 4-[3-[7-fluoro-2-(1-methylindol-3-yl)-1,3-benzoxazol-6-yl]-2-keto-1-(methoxymethyl)-1-pyrrolidino-propoxy]cyclohexanecarboxylic acid Formula: C32H36FN3O6 MolecularWeight: 577.643143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C3=NC4=C(O3)C(=C(C=C4)CC(=O)C(COC)(N5CCCC5)OC6CCC(CC6)C(=O)O)F

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C3=NC4=C(O3)C(=C(C=C4)CC(=O)C(COC)(N5CCCC5)OC6CCC(CC6)C(=O)O)F

InChI

InChI=1S/C32H36FN3O6/c1-35-18-24(23-7-3-4-8-26(23)35)30-34-25-14-11-21(28(33)29(25)41-30)17-27(37)32(19-40-2,36-15-5-6-16-36)42-22-12-9-20(10-13-22)31(38)39/h3-4,7-8,11,14,18,20,22H,5-6,9-10,12-13,15-17,19H2,1-2H3,(H,38,39)