5-chloranyl-7-[(S)-(pyridin-1-ium-2-ylamino)-thiophen-3-yl-methyl]quinolin-8-ol

Systemtic Name: 5-chloranyl-7-[(S)-(pyridin-1-ium-2-ylamino)-thiophen-3-yl-methyl]quinolin-8-ol Openeye Name: 5-chloro-7-[(S)-(pyridin-1-ium-2-ylamino)-(3-thienyl)methyl]quinolin-8-ol CAS Name: 5-chloro-7-[(S)-(2-pyridin-1-iumylamino)-(3-thiophenyl)methyl]-8-quinolinol IUPAC Name: 5-chloro-7-[(S)-(pyridin-1-ium-2-ylamino)-thiophen-3-ylmethyl]quinolin-8-ol Traditional Name: 5-chloro-7-[(S)-(pyridin-1-ium-2-ylamino)-(3-thienyl)methyl]quinolin-8-ol Formula: C19H15ClN3OS+ MolecularWeight: 368.8599

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[NH+]C(=C1)NC(C2=CSC=C2)C3=CC(=C4C=CC=NC4=C3O)Cl

Isomeric SMILES

C1=CC=[NH+]C(=C1)N[C@H](C2=CSC=C2)C3=CC(=C4C=CC=NC4=C3O)Cl

InChI

InChI=1S/C19H14ClN3OS/c20-15-10-14(19(24)18-13(15)4-3-8-22-18)17(12-6-9-25-11-12)23-16-5-1-2-7-21-16/h1-11,17,24H,(H,21,23)/p+1/t17-/m1/s1