(2S)-2-[4-(4-aminophenyl)piperazin-1-ium-1-yl]-N-prop-2-enyl-propanamide

Systemtic Name: (2S)-2-[4-(4-aminophenyl)piperazin-1-ium-1-yl]-N-prop-2-enyl-propanamide Openeye Name: (2S)-N-allyl-2-[4-(4-aminophenyl)piperazin-1-ium-1-yl]propanamide CAS Name: (2S)-2-[4-(4-aminophenyl)-1-piperazin-1-iumyl]-N-prop-2-enylpropanamide IUPAC Name: (2S)-2-[4-(4-aminophenyl)piperazin-1-ium-1-yl]-N-prop-2-enylpropanamide Traditional Name: (2S)-N-allyl-2-[4-(4-aminophenyl)piperazin-1-ium-1-yl]propionamide Formula: C16H25N4O+ MolecularWeight: 289.3959

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)[NH+]1CCN(CC1)C2=CC=C(C=C2)N

Isomeric SMILES

C[C@@H](C(=O)NCC=C)[NH+]1CCN(CC1)C2=CC=C(C=C2)N

InChI

InChI=1S/C16H24N4O/c1-3-8-18-16(21)13(2)19-9-11-20(12-10-19)15-6-4-14(17)5-7-15/h3-7,13H,1,8-12,17H2,2H3,(H,18,21)/p+1/t13-/m0/s1