2-[4-[2-(2,3-dihydro-1H-inden-5-yl)ethanoyl]piperazin-1-ium-1-yl]-N-propyl-ethanamide

Systemtic Name: 2-[4-[2-(2,3-dihydro-1H-inden-5-yl)ethanoyl]piperazin-1-ium-1-yl]-N-propyl-ethanamide Openeye Name: 2-[4-(2-indan-5-ylacetyl)piperazin-1-ium-1-yl]-N-propyl-acetamide CAS Name: 2-[4-[2-(2,3-dihydro-1H-inden-5-yl)-1-oxoethyl]-1-piperazin-1-iumyl]-N-propylacetamide IUPAC Name: 2-[4-[2-(2,3-dihydro-1H-inden-5-yl)acetyl]piperazin-1-ium-1-yl]-N-propylacetamide Traditional Name: 2-[4-(2-indan-5-ylacetyl)piperazin-1-ium-1-yl]-N-propyl-acetamide Formula: C20H30N3O2+ MolecularWeight: 344.4711

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C[NH+]1CCN(CC1)C(=O)CC2=CC3=C(CCC3)C=C2

Isomeric SMILES

CCCNC(=O)C[NH+]1CCN(CC1)C(=O)CC2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C20H29N3O2/c1-2-8-21-19(24)15-22-9-11-23(12-10-22)20(25)14-16-6-7-17-4-3-5-18(17)13-16/h6-7,13H,2-5,8-12,14-15H2,1H3,(H,21,24)/p+1