N-[2-(2-methoxyphenyl)ethyl]-2-[(2R)-3-oxidanylidene-1-(3-phenylpropyl)piperazin-1-ium-2-yl]ethanamide

Systemtic Name: N-[2-(2-methoxyphenyl)ethyl]-2-[(2R)-3-oxidanylidene-1-(3-phenylpropyl)piperazin-1-ium-2-yl]ethanamide Openeye Name: N-[2-(2-methoxyphenyl)ethyl]-2-[(2R)-3-oxo-1-(3-phenylpropyl)piperazin-1-ium-2-yl]acetamide CAS Name: N-[2-(2-methoxyphenyl)ethyl]-2-[(2R)-3-oxo-1-(3-phenylpropyl)-2-piperazin-1-iumyl]acetamide IUPAC Name: N-[2-(2-methoxyphenyl)ethyl]-2-[(2R)-3-oxo-1-(3-phenylpropyl)piperazin-1-ium-2-yl]acetamide Traditional Name: 2-[(2R)-3-keto-1-(3-phenylpropyl)piperazin-1-ium-2-yl]-N-[2-(2-methoxyphenyl)ethyl]acetamide Formula: C24H32N3O3+ MolecularWeight: 410.52918

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CCNC(=O)CC2C(=O)NCC[NH+]2CCCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1CCNC(=O)C[C@@H]2C(=O)NCC[NH+]2CCCC3=CC=CC=C3

InChI

InChI=1S/C24H31N3O3/c1-30-22-12-6-5-11-20(22)13-14-25-23(28)18-21-24(29)26-15-17-27(21)16-7-10-19-8-3-2-4-9-19/h2-6,8-9,11-12,21H,7,10,13-18H2,1H3,(H,25,28)(H,26,29)/p+1/t21-/m1/s1