(2R)-N-naphthalen-2-yl-2-(3-oxidanylidenepiperazin-1-ium-1-yl)propanamide

Systemtic Name: (2R)-N-naphthalen-2-yl-2-(3-oxidanylidenepiperazin-1-ium-1-yl)propanamide Openeye Name: (2R)-N-(2-naphthyl)-2-(3-oxopiperazin-1-ium-1-yl)propanamide CAS Name: (2R)-N-(2-naphthalenyl)-2-(3-oxo-1-piperazin-1-iumyl)propanamide IUPAC Name: (2R)-N-naphthalen-2-yl-2-(3-oxopiperazin-1-ium-1-yl)propanamide Traditional Name: (2R)-2-(3-ketopiperazin-1-ium-1-yl)-N-(2-naphthyl)propionamide Formula: C17H20N3O2+ MolecularWeight: 298.3596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=CC=CC=C2C=C1)[NH+]3CCNC(=O)C3

Isomeric SMILES

C[C@H](C(=O)NC1=CC2=CC=CC=C2C=C1)[NH+]3CCNC(=O)C3

InChI

InChI=1S/C17H19N3O2/c1-12(20-9-8-18-16(21)11-20)17(22)19-15-7-6-13-4-2-3-5-14(13)10-15/h2-7,10,12H,8-9,11H2,1H3,(H,18,21)(H,19,22)/p+1/t12-/m1/s1