[2-oxidanyl-2-[4-(1,3-thiazol-2-yl)phenyl]ethyl]-piperidin-1-ium-4-yl-azanium

Systemtic Name: [2-oxidanyl-2-[4-(1,3-thiazol-2-yl)phenyl]ethyl]-piperidin-1-ium-4-yl-azanium Openeye Name: [2-hydroxy-2-(4-thiazol-2-ylphenyl)ethyl]-piperidin-1-ium-4-yl-ammonium CAS Name: [2-hydroxy-2-[4-(2-thiazolyl)phenyl]ethyl]-(4-piperidin-1-iumyl)ammonium IUPAC Name: [2-hydroxy-2-[4-(1,3-thiazol-2-yl)phenyl]ethyl]-piperidin-1-ium-4-ylazanium Traditional Name: [2-hydroxy-2-(4-thiazol-2-ylphenyl)ethyl]-piperidin-1-ium-4-yl-ammonium Formula: C16H23N3OS+2 MolecularWeight: 305.43832

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCC1[NH2+]CC(C2=CC=C(C=C2)C3=NC=CS3)O

Isomeric SMILES

C1C[NH2+]CCC1[NH2+]CC(C2=CC=C(C=C2)C3=NC=CS3)O

InChI

InChI=1S/C16H21N3OS/c20-15(11-19-14-5-7-17-8-6-14)12-1-3-13(4-2-12)16-18-9-10-21-16/h1-4,9-10,14-15,17,19-20H,5-8,11H2/p+2