2-[[2-[5-(2-methoxyethoxy)benzimidazol-1-yl]piperidin-4-yl]-quinolin-8-yl-amino]ethanoic acid

Systemtic Name: 2-[[2-[5-(2-methoxyethoxy)benzimidazol-1-yl]piperidin-4-yl]-quinolin-8-yl-amino]ethanoic acid Openeye Name: 2-[[2-[5-(2-methoxyethoxy)benzimidazol-1-yl]-4-piperidyl]-(8-quinolyl)amino]acetic acid CAS Name: 2-[[2-[5-(2-methoxyethoxy)-1-benzimidazolyl]-4-piperidinyl]-(8-quinolinyl)amino]acetic acid IUPAC Name: 2-[[2-[5-(2-methoxyethoxy)benzimidazol-1-yl]piperidin-4-yl]-quinolin-8-ylamino]acetic acid Traditional Name: 2-[[2-[5-(2-methoxyethoxy)benzimidazol-1-yl]-4-piperidyl]-(8-quinolyl)amino]acetic acid Formula: C26H29N5O4 MolecularWeight: 475.53956

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=CC2=C(C=C1)N(C=N2)C3CC(CCN3)N(CC(=O)O)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

COCCOC1=CC2=C(C=C1)N(C=N2)C3CC(CCN3)N(CC(=O)O)C4=CC=CC5=C4N=CC=C5

InChI

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