N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(4-propylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(4-propylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(4-propylpiperazin-1-ium-1-yl)acetamide CAS Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(4-propyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(4-propylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(4-propylpiperazin-1-ium-1-yl)acetamide Formula: C18H28N3O3+ MolecularWeight: 334.43322

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CC[NH+](CC1)CC(=O)NCC2COC3=CC=CC=C3O2

Isomeric SMILES

CCCN1CC[NH+](CC1)CC(=O)NC[C@H]2COC3=CC=CC=C3O2

InChI

InChI=1S/C18H27N3O3/c1-2-7-20-8-10-21(11-9-20)13-18(22)19-12-15-14-23-16-5-3-4-6-17(16)24-15/h3-6,15H,2,7-14H2,1H3,(H,19,22)/p+1/t15-/m0/s1