N-(2,3-dihydro-1H-inden-5-yl)-3-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]propanamide

Systemtic Name: N-(2,3-dihydro-1H-inden-5-yl)-3-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]propanamide Openeye Name: 3-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]-N-indan-5-yl-propanamide CAS Name: N-(2,3-dihydro-1H-inden-5-yl)-3-[4-(2-hydroxyethyl)-1-piperazin-1-iumyl]propanamide IUPAC Name: N-(2,3-dihydro-1H-inden-5-yl)-3-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]propanamide Traditional Name: 3-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]-N-indan-5-yl-propionamide Formula: C18H28N3O2+ MolecularWeight: 318.43382

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)NC(=O)CC[NH+]3CCN(CC3)CCO

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)NC(=O)CC[NH+]3CCN(CC3)CCO

InChI

InChI=1S/C18H27N3O2/c22-13-12-21-10-8-20(9-11-21)7-6-18(23)19-17-5-4-15-2-1-3-16(15)14-17/h4-5,14,22H,1-3,6-13H2,(H,19,23)/p+1