(2R)-2-(3-oxidanylidenepiperazin-1-ium-1-yl)-N-[2-(phenylcarbonyl)phenyl]propanamide

Systemtic Name: (2R)-2-(3-oxidanylidenepiperazin-1-ium-1-yl)-N-[2-(phenylcarbonyl)phenyl]propanamide Openeye Name: (2R)-N-(2-benzoylphenyl)-2-(3-oxopiperazin-1-ium-1-yl)propanamide CAS Name: (2R)-N-(2-benzoylphenyl)-2-(3-oxo-1-piperazin-1-iumyl)propanamide IUPAC Name: (2R)-N-(2-benzoylphenyl)-2-(3-oxopiperazin-1-ium-1-yl)propanamide Traditional Name: (2R)-N-(2-benzoylphenyl)-2-(3-ketopiperazin-1-ium-1-yl)propionamide Formula: C20H22N3O3+ MolecularWeight: 352.40698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C(=O)C2=CC=CC=C2)[NH+]3CCNC(=O)C3

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1C(=O)C2=CC=CC=C2)[NH+]3CCNC(=O)C3

InChI

InChI=1S/C20H21N3O3/c1-14(23-12-11-21-18(24)13-23)20(26)22-17-10-6-5-9-16(17)19(25)15-7-3-2-4-8-15/h2-10,14H,11-13H2,1H3,(H,21,24)(H,22,26)/p+1/t14-/m1/s1