4-fluoranyl-4-[[(6-methoxycarbonyl-1H-benzimidazol-2-yl)amino]methyl]piperidine-1-carboxylic acid

Systemtic Name: 4-fluoranyl-4-[[(6-methoxycarbonyl-1H-benzimidazol-2-yl)amino]methyl]piperidine-1-carboxylic acid Openeye Name: 4-fluoro-4-[[(6-methoxycarbonyl-1H-benzimidazol-2-yl)amino]methyl]piperidine-1-carboxylic acid CAS Name: 4-fluoro-4-[[(6-methoxycarbonyl-1H-benzimidazol-2-yl)amino]methyl]-1-piperidinecarboxylic acid IUPAC Name: 4-fluoro-4-[[(6-methoxycarbonyl-1H-benzimidazol-2-yl)amino]methyl]piperidine-1-carboxylic acid Traditional Name: 4-[[(6-carbomethoxy-1H-benzimidazol-2-yl)amino]methyl]-4-fluoro-piperidine-1-carboxylic acid Formula: C16H19FN4O4 MolecularWeight: 350.344863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N=C(N2)NCC3(CCN(CC3)C(=O)O)F

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N=C(N2)NCC3(CCN(CC3)C(=O)O)F

InChI

InChI=1S/C16H19FN4O4/c1-25-13(22)10-2-3-11-12(8-10)20-14(19-11)18-9-16(17)4-6-21(7-5-16)15(23)24/h2-3,8H,4-7,9H2,1H3,(H,23,24)(H2,18,19,20)