(2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-phenethyl-propanamide

Systemtic Name: (2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-phenethyl-propanamide Openeye Name: (2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-phenethyl-propanamide CAS Name: (2R)-2-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]-N-phenethylpropanamide IUPAC Name: (2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-phenethylpropanamide Traditional Name: (2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-phenethyl-propionamide Formula: C22H30N3O2+ MolecularWeight: 368.4925

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC=CC=C1)[NH+]2CCN(CC2)C3=CC=CC=C3OC

Isomeric SMILES

C[C@H](C(=O)NCCC1=CC=CC=C1)[NH+]2CCN(CC2)C3=CC=CC=C3OC

InChI

InChI=1S/C22H29N3O2/c1-18(22(26)23-13-12-19-8-4-3-5-9-19)24-14-16-25(17-15-24)20-10-6-7-11-21(20)27-2/h3-11,18H,12-17H2,1-2H3,(H,23,26)/p+1/t18-/m1/s1