5-chloranyl-7-[(S)-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]-pyridin-2-yl-methyl]quinolin-8-ol

Systemtic Name: 5-chloranyl-7-[(S)-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]-pyridin-2-yl-methyl]quinolin-8-ol Openeye Name: 5-chloro-7-[(S)-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]-(2-pyridyl)methyl]quinolin-8-ol CAS Name: 5-chloro-7-[(S)-[4-(2-hydroxyethyl)-1-piperazin-1-iumyl]-(2-pyridinyl)methyl]-8-quinolinol IUPAC Name: 5-chloro-7-[(S)-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]-pyridin-2-ylmethyl]quinolin-8-ol Traditional Name: 5-chloro-7-[(S)-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]-(2-pyridyl)methyl]quinolin-8-ol Formula: C21H24ClN4O2+ MolecularWeight: 399.89386

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=N2)C3=CC(=C4C=CC=NC4=C3O)Cl)CCO

Isomeric SMILES

C1CN(CC[NH+]1[C@H](C2=CC=CC=N2)C3=CC(=C4C=CC=NC4=C3O)Cl)CCO

InChI

InChI=1S/C21H23ClN4O2/c22-17-14-16(21(28)19-15(17)4-3-7-24-19)20(18-5-1-2-6-23-18)26-10-8-25(9-11-26)12-13-27/h1-7,14,20,27-28H,8-13H2/p+1/t20-/m0/s1