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

Systemtic Name: 7-[(R)-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]-thiophen-2-yl-methyl]quinolin-8-ol Openeye Name: 7-[(R)-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]-(2-thienyl)methyl]quinolin-8-ol CAS Name: 7-[(R)-[4-(2-hydroxyethyl)-1-piperazine-1,4-diiumyl]-thiophen-2-ylmethyl]-8-quinolinol IUPAC Name: 7-[(R)-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]-thiophen-2-ylmethyl]quinolin-8-ol Traditional Name: 7-[(R)-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]-(2-thienyl)methyl]quinolin-8-ol Formula: C20H25N3O2S+2 MolecularWeight: 371.4964

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CCO)C(C2=C(C3=C(C=CC=N3)C=C2)O)C4=CC=CS4

Isomeric SMILES

C1C[NH+](CC[NH+]1CCO)[C@H](C2=C(C3=C(C=CC=N3)C=C2)O)C4=CC=CS4

InChI

InChI=1S/C20H23N3O2S/c24-13-12-22-8-10-23(11-9-22)19(17-4-2-14-26-17)16-6-5-15-3-1-7-21-18(15)20(16)25/h1-7,14,19,24-25H,8-13H2/p+2/t19-/m1/s1