N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2-methoxyethyl)-4-(2-methoxyphenyl)-1,3-thiazol-3-ium-2-amine

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2-methoxyethyl)-4-(2-methoxyphenyl)-1,3-thiazol-3-ium-2-amine Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2-methoxyethyl)-4-(2-methoxyphenyl)thiazol-3-ium-2-amine CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2-methoxyethyl)-4-(2-methoxyphenyl)-2-thiazol-3-iumamine IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2-methoxyethyl)-4-(2-methoxyphenyl)-1,3-thiazol-3-ium-2-amine Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[3-(2-methoxyethyl)-4-(2-methoxyphenyl)thiazol-3-ium-2-yl]amine Formula: C21H23N2O4S+ MolecularWeight: 399.48332

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Descriptors Computed from Structure

Canonical SMILES:

COCC[N+]1=C(SC=C1C2=CC=CC=C2OC)NC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

COCC[N+]1=C(SC=C1C2=CC=CC=C2OC)NC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H22N2O4S/c1-24-10-9-23-17(16-5-3-4-6-18(16)25-2)14-28-21(23)22-15-7-8-19-20(13-15)27-12-11-26-19/h3-8,13-14H,9-12H2,1-2H3/p+1