(2S)-N-(4-ethylphenyl)-2-(4-ethylpiperazin-1-ium-1-yl)propanamide

Systemtic Name: (2S)-N-(4-ethylphenyl)-2-(4-ethylpiperazin-1-ium-1-yl)propanamide Openeye Name: (2S)-N-(4-ethylphenyl)-2-(4-ethylpiperazin-1-ium-1-yl)propanamide CAS Name: (2S)-N-(4-ethylphenyl)-2-(4-ethyl-1-piperazin-1-iumyl)propanamide IUPAC Name: (2S)-N-(4-ethylphenyl)-2-(4-ethylpiperazin-1-ium-1-yl)propanamide Traditional Name: (2S)-N-(4-ethylphenyl)-2-(4-ethylpiperazin-1-ium-1-yl)propionamide Formula: C17H28N3O+ MolecularWeight: 290.42372

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(C)[NH+]2CCN(CC2)CC

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)[C@H](C)[NH+]2CCN(CC2)CC

InChI

InChI=1S/C17H27N3O/c1-4-15-6-8-16(9-7-15)18-17(21)14(3)20-12-10-19(5-2)11-13-20/h6-9,14H,4-5,10-13H2,1-3H3,(H,18,21)/p+1/t14-/m0/s1