7-[(R)-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]-pyridin-2-yl-methyl]quinolin-8-ol

Systemtic Name: 7-[(R)-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]-pyridin-2-yl-methyl]quinolin-8-ol Openeye Name: 7-[(R)-(4-benzylpiperazine-1,4-diium-1-yl)-(2-pyridyl)methyl]quinolin-8-ol CAS Name: 7-[(R)-[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]-(2-pyridinyl)methyl]-8-quinolinol IUPAC Name: 7-[(R)-(4-benzylpiperazine-1,4-diium-1-yl)-pyridin-2-ylmethyl]quinolin-8-ol Traditional Name: 7-[(R)-(4-benzylpiperazine-1,4-diium-1-yl)-(2-pyridyl)methyl]quinolin-8-ol Formula: C26H28N4O+2 MolecularWeight: 412.52672

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC2=CC=CC=C2)C(C3=C(C4=C(C=CC=N4)C=C3)O)C5=CC=CC=N5

Isomeric SMILES

C1C[NH+](CC[NH+]1CC2=CC=CC=C2)[C@H](C3=C(C4=C(C=CC=N4)C=C3)O)C5=CC=CC=N5

InChI

InChI=1S/C26H26N4O/c31-26-22(12-11-21-9-6-14-28-24(21)26)25(23-10-4-5-13-27-23)30-17-15-29(16-18-30)19-20-7-2-1-3-8-20/h1-14,25,31H,15-19H2/p+2/t25-/m1/s1