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

Systemtic Name: 7-[(pyridin-1-ium-2-ylamino)-thiophen-2-yl-methyl]quinolin-1-ium-8-ol Openeye Name: 7-[(pyridin-1-ium-2-ylamino)-(2-thienyl)methyl]quinolin-1-ium-8-ol CAS Name: 7-[(2-pyridin-1-iumylamino)-thiophen-2-ylmethyl]-8-quinolin-1-iumol IUPAC Name: 7-[(pyridin-1-ium-2-ylamino)-thiophen-2-ylmethyl]quinolin-1-ium-8-ol Traditional Name: 7-[(pyridin-1-ium-2-ylamino)-(2-thienyl)methyl]quinolin-1-ium-8-ol Formula: C19H17N3OS+2 MolecularWeight: 335.42278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[NH+]C(=C1)NC(C2=C(C3=C(C=CC=[NH+]3)C=C2)O)C4=CC=CS4

Isomeric SMILES

C1=CC=[NH+]C(=C1)NC(C2=C(C3=C(C=CC=[NH+]3)C=C2)O)C4=CC=CS4

InChI

InChI=1S/C19H15N3OS/c23-19-14(9-8-13-5-3-11-21-17(13)19)18(15-6-4-12-24-15)22-16-7-1-2-10-20-16/h1-12,18,23H,(H,20,22)/p+2