2-[5-aminocarbonyl-2-[4-fluoranyl-4-(phenylmethyl)piperidin-1-yl]-6-methoxy-1-methyl-indol-3-yl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[5-aminocarbonyl-2-[4-fluoranyl-4-(phenylmethyl)piperidin-1-yl]-6-methoxy-1-methyl-indol-3-yl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[2-(4-benzyl-4-fluoro-1-piperidyl)-5-carbamoyl-6-methoxy-1-methyl-indol-3-yl]-2-oxo-acetic acid CAS Name: 2-[5-carbamoyl-2-[4-fluoro-4-(phenylmethyl)-1-piperidinyl]-6-methoxy-1-methyl-3-indolyl]-2-oxoacetic acid IUPAC Name: 2-[2-(4-benzyl-4-fluoropiperidin-1-yl)-5-carbamoyl-6-methoxy-1-methylindol-3-yl]-2-oxoacetic acid Traditional Name: 2-[2-(4-benzyl-4-fluoro-piperidino)-5-carbamoyl-6-methoxy-1-methyl-indol-3-yl]-2-keto-acetic acid Formula: C25H26FN3O5 MolecularWeight: 467.489443

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC(=C(C=C2C(=C1N3CCC(CC3)(CC4=CC=CC=C4)F)C(=O)C(=O)O)C(=O)N)OC

Isomeric SMILES

CN1C2=CC(=C(C=C2C(=C1N3CCC(CC3)(CC4=CC=CC=C4)F)C(=O)C(=O)O)C(=O)N)OC

InChI

InChI=1S/C25H26FN3O5/c1-28-18-13-19(34-2)17(22(27)31)12-16(18)20(21(30)24(32)33)23(28)29-10-8-25(26,9-11-29)14-15-6-4-3-5-7-15/h3-7,12-13H,8-11,14H2,1-2H3,(H2,27,31)(H,32,33)