8-[(4-propylpiperazin-4-ium-1-yl)methyl]-4H-1,3-benzodioxin-6-amine

Systemtic Name: 8-[(4-propylpiperazin-4-ium-1-yl)methyl]-4H-1,3-benzodioxin-6-amine Openeye Name: 8-[(4-propylpiperazin-4-ium-1-yl)methyl]-4H-1,3-benzodioxin-6-amine CAS Name: 8-[(4-propyl-1-piperazin-4-iumyl)methyl]-4H-1,3-benzodioxin-6-amine IUPAC Name: 8-[(4-propylpiperazin-4-ium-1-yl)methyl]-4H-1,3-benzodioxin-6-amine Traditional Name: [8-[(4-propylpiperazin-4-ium-1-yl)methyl]-4H-1,3-benzodioxin-6-yl]amine Formula: C16H26N3O2+ MolecularWeight: 292.39654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)CC2=C3C(=CC(=C2)N)COCO3

Isomeric SMILES

CCC[NH+]1CCN(CC1)CC2=C3C(=CC(=C2)N)COCO3

InChI

InChI=1S/C16H25N3O2/c1-2-3-18-4-6-19(7-5-18)10-13-8-15(17)9-14-11-20-12-21-16(13)14/h8-9H,2-7,10-12,17H2,1H3/p+1