2-[4-(1,3-benzodioxol-5-yl)-2-phenylazanyl-1,3-thiazol-3-ium-3-yl]ethanol

Systemtic Name: 2-[4-(1,3-benzodioxol-5-yl)-2-phenylazanyl-1,3-thiazol-3-ium-3-yl]ethanol Openeye Name: 2-[2-anilino-4-(1,3-benzodioxol-5-yl)thiazol-3-ium-3-yl]ethanol CAS Name: 2-[2-anilino-4-(1,3-benzodioxol-5-yl)-3-thiazol-3-iumyl]ethanol IUPAC Name: 2-[2-anilino-4-(1,3-benzodioxol-5-yl)-1,3-thiazol-3-ium-3-yl]ethanol Traditional Name: 2-[2-anilino-4-(1,3-benzodioxol-5-yl)thiazol-3-ium-3-yl]ethanol Formula: C18H17N2O3S+ MolecularWeight: 341.40418

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CSC(=[N+]3CCO)NC4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CSC(=[N+]3CCO)NC4=CC=CC=C4

InChI

InChI=1S/C18H16N2O3S/c21-9-8-20-15(13-6-7-16-17(10-13)23-12-22-16)11-24-18(20)19-14-4-2-1-3-5-14/h1-7,10-11,21H,8-9,12H2/p+1