N-[(2R)-4-(4-methoxyphenyl)butan-2-yl]-4-methyl-piperazin-1-ium-1-amine

Systemtic Name: N-[(2R)-4-(4-methoxyphenyl)butan-2-yl]-4-methyl-piperazin-1-ium-1-amine Openeye Name: N-[(1R)-3-(4-methoxyphenyl)-1-methyl-propyl]-4-methyl-piperazin-1-ium-1-amine CAS Name: N-[(2R)-4-(4-methoxyphenyl)butan-2-yl]-4-methyl-1-piperazin-1-iumamine IUPAC Name: N-[(2R)-4-(4-methoxyphenyl)butan-2-yl]-4-methylpiperazin-1-ium-1-amine Traditional Name: [(1R)-3-(4-methoxyphenyl)-1-methyl-propyl]-(4-methylpiperazin-1-ium-1-yl)amine Formula: C16H28N3O+ MolecularWeight: 278.41302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(C=C1)OC)N[NH+]2CCN(CC2)C

Isomeric SMILES

C[C@H](CCC1=CC=C(C=C1)OC)N[NH+]2CCN(CC2)C

InChI

InChI=1S/C16H27N3O/c1-14(17-19-12-10-18(2)11-13-19)4-5-15-6-8-16(20-3)9-7-15/h6-9,14,17H,4-5,10-13H2,1-3H3/p+1/t14-/m1/s1