N-[(1R)-1-(4-methoxyphenyl)-2-methyl-propyl]-2-[4-(pyridin-2-ylmethyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[(1R)-1-(4-methoxyphenyl)-2-methyl-propyl]-2-[4-(pyridin-2-ylmethyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-[(1R)-1-(4-methoxyphenyl)-2-methyl-propyl]-2-[4-(2-pyridylmethyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[(1R)-1-(4-methoxyphenyl)-2-methylpropyl]-2-[4-(2-pyridinylmethyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[(1R)-1-(4-methoxyphenyl)-2-methylpropyl]-2-[4-(pyridin-2-ylmethyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-[(1R)-1-(4-methoxyphenyl)-2-methyl-propyl]-2-[4-(2-pyridylmethyl)piperazin-1-ium-1-yl]acetamide Formula: C23H33N4O2+ MolecularWeight: 397.53372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=C(C=C1)OC)NC(=O)C[NH+]2CCN(CC2)CC3=CC=CC=N3

Isomeric SMILES

CC(C)[C@H](C1=CC=C(C=C1)OC)NC(=O)C[NH+]2CCN(CC2)CC3=CC=CC=N3

InChI

InChI=1S/C23H32N4O2/c1-18(2)23(19-7-9-21(29-3)10-8-19)25-22(28)17-27-14-12-26(13-15-27)16-20-6-4-5-11-24-20/h4-11,18,23H,12-17H2,1-3H3,(H,25,28)/p+1/t23-/m1/s1