N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(4-phenoxyphenyl)-3-prop-2-enyl-1,3-thiazol-3-ium-2-amine

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(4-phenoxyphenyl)-3-prop-2-enyl-1,3-thiazol-3-ium-2-amine Openeye Name: 3-allyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(4-phenoxyphenyl)thiazol-3-ium-2-amine CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(4-phenoxyphenyl)-3-prop-2-enyl-2-thiazol-3-iumamine IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(4-phenoxyphenyl)-3-prop-2-enyl-1,3-thiazol-3-ium-2-amine Traditional Name: [3-allyl-4-(4-phenoxyphenyl)thiazol-3-ium-2-yl]-(2,3-dihydro-1,4-benzodioxin-6-yl)amine Formula: C26H23N2O3S+ MolecularWeight: 443.53742

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[N+]1=C(SC=C1C2=CC=C(C=C2)OC3=CC=CC=C3)NC4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C=CC[N+]1=C(SC=C1C2=CC=C(C=C2)OC3=CC=CC=C3)NC4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C26H22N2O3S/c1-2-14-28-23(19-8-11-22(12-9-19)31-21-6-4-3-5-7-21)18-32-26(28)27-20-10-13-24-25(17-20)30-16-15-29-24/h2-13,17-18H,1,14-16H2/p+1