3-[4-[[(6-fluoranyl-3,3-dimethyl-2-oxidanylidene-indol-1-yl)carbonylamino]methyl]piperidin-1-yl]propanoic acid

Systemtic Name: 3-[4-[[(6-fluoranyl-3,3-dimethyl-2-oxidanylidene-indol-1-yl)carbonylamino]methyl]piperidin-1-yl]propanoic acid Openeye Name: 3-[4-[[(6-fluoro-3,3-dimethyl-2-oxo-indoline-1-carbonyl)amino]methyl]-1-piperidyl]propanoic acid CAS Name: 3-[4-[[[(6-fluoro-3,3-dimethyl-2-oxo-1-indolyl)-oxomethyl]amino]methyl]-1-piperidinyl]propanoic acid IUPAC Name: 3-[4-[[(6-fluoro-3,3-dimethyl-2-oxoindole-1-carbonyl)amino]methyl]piperidin-1-yl]propanoic acid Traditional Name: 3-[4-[[(6-fluoro-2-keto-3,3-dimethyl-indoline-1-carbonyl)amino]methyl]piperidino]propionic acid Formula: C20H26FN3O4 MolecularWeight: 391.436543

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=C(C=C2)F)N(C1=O)C(=O)NCC3CCN(CC3)CCC(=O)O)C

Isomeric SMILES

CC1(C2=C(C=C(C=C2)F)N(C1=O)C(=O)NCC3CCN(CC3)CCC(=O)O)C

InChI

InChI=1S/C20H26FN3O4/c1-20(2)15-4-3-14(21)11-16(15)24(18(20)27)19(28)22-12-13-5-8-23(9-6-13)10-7-17(25)26/h3-4,11,13H,5-10,12H2,1-2H3,(H,22,28)(H,25,26)