2-[4-[[4-methyl-1-[(6-methyl-3-oxidanyl-pyridin-2-yl)methyl]benzimidazol-2-yl]amino]piperidin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[[4-methyl-1-[(6-methyl-3-oxidanyl-pyridin-2-yl)methyl]benzimidazol-2-yl]amino]piperidin-1-yl]ethanoic acid Openeye Name: 2-[4-[[1-[(3-hydroxy-6-methyl-2-pyridyl)methyl]-4-methyl-benzimidazol-2-yl]amino]-1-piperidyl]acetic acid CAS Name: 2-[4-[[1-[(3-hydroxy-6-methyl-2-pyridinyl)methyl]-4-methyl-2-benzimidazolyl]amino]-1-piperidinyl]acetic acid IUPAC Name: 2-[4-[[1-[(3-hydroxy-6-methylpyridin-2-yl)methyl]-4-methylbenzimidazol-2-yl]amino]piperidin-1-yl]acetic acid Traditional Name: 2-[4-[[1-[(3-hydroxy-6-methyl-2-pyridyl)methyl]-4-methyl-benzimidazol-2-yl]amino]piperidino]acetic acid Formula: C22H27N5O3 MolecularWeight: 409.48148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N(C(=N2)NC3CCN(CC3)CC(=O)O)CC4=C(C=CC(=N4)C)O

Isomeric SMILES

CC1=C2C(=CC=C1)N(C(=N2)NC3CCN(CC3)CC(=O)O)CC4=C(C=CC(=N4)C)O

InChI

InChI=1S/C22H27N5O3/c1-14-4-3-5-18-21(14)25-22(24-16-8-10-26(11-9-16)13-20(29)30)27(18)12-17-19(28)7-6-15(2)23-17/h3-7,16,28H,8-13H2,1-2H3,(H,24,25)(H,29,30)