N-(2-ethylphenyl)-2-[4-[(2S)-2-(3-methylphenoxy)propanoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-ethylphenyl)-2-[4-[(2S)-2-(3-methylphenoxy)propanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2-ethylphenyl)-2-[4-[(2S)-2-(3-methylphenoxy)propanoyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-(2-ethylphenyl)-2-[4-[(2S)-2-(3-methylphenoxy)-1-oxopropyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2-ethylphenyl)-2-[4-[(2S)-2-(3-methylphenoxy)propanoyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2-ethylphenyl)-2-[4-[(2S)-2-(3-methylphenoxy)propanoyl]piperazin-1-ium-1-yl]acetamide Formula: C24H32N3O3+ MolecularWeight: 410.52918

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)C(=O)C(C)OC3=CC=CC(=C3)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)C(=O)[C@H](C)OC3=CC=CC(=C3)C

InChI

InChI=1S/C24H31N3O3/c1-4-20-9-5-6-11-22(20)25-23(28)17-26-12-14-27(15-13-26)24(29)19(3)30-21-10-7-8-18(2)16-21/h5-11,16,19H,4,12-15,17H2,1-3H3,(H,25,28)/p+1/t19-/m0/s1