4-[1-[8-(4-azanylpiperidin-1-yl)quinolin-2-yl]benzimidazol-5-yl]benzoic acid

Systemtic Name: 4-[1-[8-(4-azanylpiperidin-1-yl)quinolin-2-yl]benzimidazol-5-yl]benzoic acid Openeye Name: 4-[1-[8-(4-amino-1-piperidyl)-2-quinolyl]benzimidazol-5-yl]benzoic acid CAS Name: 4-[1-[8-(4-amino-1-piperidinyl)-2-quinolinyl]-5-benzimidazolyl]benzoic acid IUPAC Name: 4-[1-[8-(4-aminopiperidin-1-yl)quinolin-2-yl]benzimidazol-5-yl]benzoic acid Traditional Name: 4-[1-[8-(4-aminopiperidino)-2-quinolyl]benzimidazol-5-yl]benzoic acid Formula: C28H25N5O2 MolecularWeight: 463.5304

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N)C2=CC=CC3=C2N=C(C=C3)N4C=NC5=C4C=CC(=C5)C6=CC=C(C=C6)C(=O)O

Isomeric SMILES

C1CN(CCC1N)C2=CC=CC3=C2N=C(C=C3)N4C=NC5=C4C=CC(=C5)C6=CC=C(C=C6)C(=O)O

InChI

InChI=1S/C28H25N5O2/c29-22-12-14-32(15-13-22)25-3-1-2-19-9-11-26(31-27(19)25)33-17-30-23-16-21(8-10-24(23)33)18-4-6-20(7-5-18)28(34)35/h1-11,16-17,22H,12-15,29H2,(H,34,35)