(2S)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-N-methyl-propanamide

Systemtic Name: (2S)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-N-methyl-propanamide Openeye Name: (2S)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-N-methyl-propanamide CAS Name: (2S)-2-[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]-N-methylpropanamide IUPAC Name: (2S)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-N-methylpropanamide Traditional Name: (2S)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-N-methyl-propionamide Formula: C15H24N3O2+ MolecularWeight: 278.36996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC)[NH+]1CCN(CC1)C2=CC=C(C=C2)OC

Isomeric SMILES

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

InChI

InChI=1S/C15H23N3O2/c1-12(15(19)16-2)17-8-10-18(11-9-17)13-4-6-14(20-3)7-5-13/h4-7,12H,8-11H2,1-3H3,(H,16,19)/p+1/t12-/m0/s1