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

Systemtic Name: 2-[[1-[8-(4-azanylpiperidin-1-yl)quinolin-2-yl]-6-oxidanyl-benzimidazol-5-yl]oxymethyl]-2-methyl-propane-1,3-diol Openeye Name: 2-[[1-[8-(4-amino-1-piperidyl)-2-quinolyl]-6-hydroxy-benzimidazol-5-yl]oxymethyl]-2-methyl-propane-1,3-diol CAS Name: 2-[[1-[8-(4-amino-1-piperidinyl)-2-quinolinyl]-6-hydroxy-5-benzimidazolyl]oxymethyl]-2-methylpropane-1,3-diol IUPAC Name: 2-[[1-[8-(4-aminopiperidin-1-yl)quinolin-2-yl]-6-hydroxybenzimidazol-5-yl]oxymethyl]-2-methylpropane-1,3-diol Traditional Name: 2-[[1-[8-(4-aminopiperidino)-2-quinolyl]-6-hydroxy-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=C(C=C2C(=C1)N=CN2C3=NC4=C(C=CC=C4N5CCC(CC5)N)C=C3)O

Isomeric SMILES

CC(CO)(CO)COC1=C(C=C2C(=C1)N=CN2C3=NC4=C(C=CC=C4N5CCC(CC5)N)C=C3)O

InChI

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