(2S)-N-ethyl-N-phenyl-2-piperazin-4-ium-1-yl-propanamide

Systemtic Name: (2S)-N-ethyl-N-phenyl-2-piperazin-4-ium-1-yl-propanamide Openeye Name: (2S)-N-ethyl-N-phenyl-2-piperazin-4-ium-1-yl-propanamide CAS Name: (2S)-N-ethyl-N-phenyl-2-(1-piperazin-4-iumyl)propanamide IUPAC Name: (2S)-N-ethyl-N-phenyl-2-piperazin-4-ium-1-ylpropanamide Traditional Name: (2S)-N-ethyl-N-phenyl-2-piperazin-4-ium-1-yl-propionamide Formula: C15H24N3O+ MolecularWeight: 262.37056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23N3O/c1-3-18(14-7-5-4-6-8-14)15(19)13(2)17-11-9-16-10-12-17/h4-8,13,16H,3,9-12H2,1-2H3/p+1/t13-/m0/s1