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

Systemtic Name: 7-[(R)-(4-ethylpiperazine-1,4-diium-1-yl)-thiophen-2-yl-methyl]quinolin-8-ol Openeye Name: 7-[(R)-(4-ethylpiperazine-1,4-diium-1-yl)-(2-thienyl)methyl]quinolin-8-ol CAS Name: 7-[(R)-(4-ethyl-1-piperazine-1,4-diiumyl)-thiophen-2-ylmethyl]-8-quinolinol IUPAC Name: 7-[(R)-(4-ethylpiperazine-1,4-diium-1-yl)-thiophen-2-ylmethyl]quinolin-8-ol Traditional Name: 7-[(R)-(4-ethylpiperazine-1,4-diium-1-yl)-(2-thienyl)methyl]quinolin-8-ol Formula: C20H25N3OS+2 MolecularWeight: 355.497

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)C(C2=C(C3=C(C=CC=N3)C=C2)O)C4=CC=CS4

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)[C@H](C2=C(C3=C(C=CC=N3)C=C2)O)C4=CC=CS4

InChI

InChI=1S/C20H23N3OS/c1-2-22-10-12-23(13-11-22)19(17-6-4-14-25-17)16-8-7-15-5-3-9-21-18(15)20(16)24/h3-9,14,19,24H,2,10-13H2,1H3/p+2/t19-/m1/s1