2-[[1-[8-(4-azanylpiperidin-1-yl)-6-oxidanyl-quinolin-2-yl]benzimidazol-5-yl]oxymethyl]-2-methyl-propane-1,3-diol

Systemtic Name: 2-[[1-[8-(4-azanylpiperidin-1-yl)-6-oxidanyl-quinolin-2-yl]benzimidazol-5-yl]oxymethyl]-2-methyl-propane-1,3-diol Openeye Name: 2-[[1-[8-(4-amino-1-piperidyl)-6-hydroxy-2-quinolyl]benzimidazol-5-yl]oxymethyl]-2-methyl-propane-1,3-diol CAS Name: 2-[[1-[8-(4-amino-1-piperidinyl)-6-hydroxy-2-quinolinyl]-5-benzimidazolyl]oxymethyl]-2-methylpropane-1,3-diol IUPAC Name: 2-[[1-[8-(4-aminopiperidin-1-yl)-6-hydroxyquinolin-2-yl]benzimidazol-5-yl]oxymethyl]-2-methylpropane-1,3-diol Traditional Name: 2-[[1-[8-(4-aminopiperidino)-6-hydroxy-2-quinolyl]benzimidazol-5-yl]oxymethyl]-2-methyl-propane-1,3-diol Formula: C26H31N5O4 MolecularWeight: 477.55544

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(CO)COC1=CC2=C(C=C1)N(C=N2)C3=NC4=C(C=C(C=C4C=C3)O)N5CCC(CC5)N

Isomeric SMILES

CC(CO)(CO)COC1=CC2=C(C=C1)N(C=N2)C3=NC4=C(C=C(C=C4C=C3)O)N5CCC(CC5)N

InChI

InChI=1S/C26H31N5O4/c1-26(13-32,14-33)15-35-20-3-4-22-21(12-20)28-16-31(22)24-5-2-17-10-19(34)11-23(25(17)29-24)30-8-6-18(27)7-9-30/h2-5,10-12,16,18,32-34H,6-9,13-15,27H2,1H3