N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-(1-propan-2-ylbenzimidazol-2-yl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-(1-propan-2-ylbenzimidazol-2-yl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-(1-isopropylbenzimidazol-2-yl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-(1-propan-2-yl-2-benzimidazolyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-(1-propan-2-ylbenzimidazol-2-yl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-(1-isopropylbenzimidazol-2-yl)piperazin-1-ium-1-yl]acetamide Formula: C24H30N5O3+ MolecularWeight: 436.5267

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=CC=CC=C2N=C1N3CC[NH+](CC3)CC(=O)NC4=CC5=C(C=C4)OCCO5

Isomeric SMILES

CC(C)N1C2=CC=CC=C2N=C1N3CC[NH+](CC3)CC(=O)NC4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C24H29N5O3/c1-17(2)29-20-6-4-3-5-19(20)26-24(29)28-11-9-27(10-12-28)16-23(30)25-18-7-8-21-22(15-18)32-14-13-31-21/h3-8,15,17H,9-14,16H2,1-2H3,(H,25,30)/p+1