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

Systemtic Name: (2S)-N-(4-dimethylaminophenyl)-2-piperazin-4-ium-1-yl-propanamide Openeye Name: (2S)-N-(4-dimethylaminophenyl)-2-piperazin-4-ium-1-yl-propanamide CAS Name: (2S)-N-(4-dimethylaminophenyl)-2-(1-piperazin-4-iumyl)propanamide IUPAC Name: (2S)-N-(4-dimethylaminophenyl)-2-piperazin-4-ium-1-ylpropanamide Traditional Name: (2S)-N-(4-dimethylaminophenyl)-2-piperazin-4-ium-1-yl-propionamide Formula: C15H25N4O+ MolecularWeight: 277.3852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H24N4O/c1-12(19-10-8-16-9-11-19)15(20)17-13-4-6-14(7-5-13)18(2)3/h4-7,12,16H,8-11H2,1-3H3,(H,17,20)/p+1/t12-/m0/s1