2-[[1-[8-(4-azanylpiperidin-1-yl)quinolin-2-yl]benzimidazol-5-yl]oxymethyl]-2-methyl-3-oxidanyl-propanoic acid

Systemtic Name: 2-[[1-[8-(4-azanylpiperidin-1-yl)quinolin-2-yl]benzimidazol-5-yl]oxymethyl]-2-methyl-3-oxidanyl-propanoic acid Openeye Name: 2-[[1-[8-(4-amino-1-piperidyl)-2-quinolyl]benzimidazol-5-yl]oxymethyl]-3-hydroxy-2-methyl-propanoic acid CAS Name: 2-[[1-[8-(4-amino-1-piperidinyl)-2-quinolinyl]-5-benzimidazolyl]oxymethyl]-3-hydroxy-2-methylpropanoic acid IUPAC Name: 2-[[1-[8-(4-aminopiperidin-1-yl)quinolin-2-yl]benzimidazol-5-yl]oxymethyl]-3-hydroxy-2-methylpropanoic acid Traditional Name: 2-[[1-[8-(4-aminopiperidino)-2-quinolyl]benzimidazol-5-yl]oxymethyl]-3-hydroxy-2-methyl-propionic acid Formula: C26H29N5O4 MolecularWeight: 475.53956

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(COC1=CC2=C(C=C1)N(C=N2)C3=NC4=C(C=CC=C4N5CCC(CC5)N)C=C3)C(=O)O

Isomeric SMILES

CC(CO)(COC1=CC2=C(C=C1)N(C=N2)C3=NC4=C(C=CC=C4N5CCC(CC5)N)C=C3)C(=O)O

InChI

InChI=1S/C26H29N5O4/c1-26(14-32,25(33)34)15-35-19-6-7-21-20(13-19)28-16-31(21)23-8-5-17-3-2-4-22(24(17)29-23)30-11-9-18(27)10-12-30/h2-8,13,16,18,32H,9-12,14-15,27H2,1H3,(H,33,34)