2-[4-(4-aminophenyl)piperazin-1-ium-1-yl]-N-[(2S)-butan-2-yl]ethanamide

Systemtic Name: 2-[4-(4-aminophenyl)piperazin-1-ium-1-yl]-N-[(2S)-butan-2-yl]ethanamide Openeye Name: 2-[4-(4-aminophenyl)piperazin-1-ium-1-yl]-N-[(1S)-1-methylpropyl]acetamide CAS Name: 2-[4-(4-aminophenyl)-1-piperazin-1-iumyl]-N-[(2S)-butan-2-yl]acetamide IUPAC Name: 2-[4-(4-aminophenyl)piperazin-1-ium-1-yl]-N-[(2S)-butan-2-yl]acetamide Traditional Name: 2-[4-(4-aminophenyl)piperazin-1-ium-1-yl]-N-[(1S)-1-methylpropyl]acetamide Formula: C16H27N4O+ MolecularWeight: 291.41178

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C[NH+]1CCN(CC1)C2=CC=C(C=C2)N

Isomeric SMILES

CC[C@H](C)NC(=O)C[NH+]1CCN(CC1)C2=CC=C(C=C2)N

InChI

InChI=1S/C16H26N4O/c1-3-13(2)18-16(21)12-19-8-10-20(11-9-19)15-6-4-14(17)5-7-15/h4-7,13H,3,8-12,17H2,1-2H3,(H,18,21)/p+1/t13-/m0/s1