4-[[(2S)-2-piperazin-4-ium-1-ylpropanoyl]amino]benzamide

Systemtic Name: 4-[[(2S)-2-piperazin-4-ium-1-ylpropanoyl]amino]benzamide Openeye Name: 4-[[(2S)-2-piperazin-4-ium-1-ylpropanoyl]amino]benzamide CAS Name: 4-[[(2S)-1-oxo-2-(1-piperazin-4-iumyl)propyl]amino]benzamide IUPAC Name: 4-[[(2S)-2-piperazin-4-ium-1-ylpropanoyl]amino]benzamide Traditional Name: 4-[[(2S)-2-piperazin-4-ium-1-ylpropanoyl]amino]benzamide Formula: C14H21N4O2+ MolecularWeight: 277.34214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(=O)N)N2CC[NH2+]CC2

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)C(=O)N)N2CC[NH2+]CC2

InChI

InChI=1S/C14H20N4O2/c1-10(18-8-6-16-7-9-18)14(20)17-12-4-2-11(3-5-12)13(15)19/h2-5,10,16H,6-9H2,1H3,(H2,15,19)(H,17,20)/p+1/t10-/m0/s1