(2R)-1-[2-[4-(phenylcarbonyl)piperazin-1-ium-1-yl]ethanoyl]piperidine-2-carboxamide

Systemtic Name: (2R)-1-[2-[4-(phenylcarbonyl)piperazin-1-ium-1-yl]ethanoyl]piperidine-2-carboxamide Openeye Name: (2R)-1-[2-(4-benzoylpiperazin-1-ium-1-yl)acetyl]piperidine-2-carboxamide CAS Name: (2R)-1-[2-(4-benzoyl-1-piperazin-1-iumyl)-1-oxoethyl]-2-piperidinecarboxamide IUPAC Name: (2R)-1-[2-(4-benzoylpiperazin-1-ium-1-yl)acetyl]piperidine-2-carboxamide Traditional Name: (2R)-1-[2-(4-benzoylpiperazin-1-ium-1-yl)acetyl]pipecolinamide Formula: C19H27N4O3+ MolecularWeight: 359.44268

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)N)C(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCN([C@H](C1)C(=O)N)C(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H26N4O3/c20-18(25)16-8-4-5-9-23(16)17(24)14-21-10-12-22(13-11-21)19(26)15-6-2-1-3-7-15/h1-3,6-7,16H,4-5,8-14H2,(H2,20,25)/p+1/t16-/m1/s1