N-(2-ethylphenyl)-2-[4-[(3S)-1-(2-methylpropanoyl)piperidin-3-yl]carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-ethylphenyl)-2-[4-[(3S)-1-(2-methylpropanoyl)piperidin-3-yl]carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2-ethylphenyl)-2-[4-[(3S)-1-(2-methylpropanoyl)piperidine-3-carbonyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-(2-ethylphenyl)-2-[4-[[(3S)-1-(2-methyl-1-oxopropyl)-3-piperidinyl]-oxomethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2-ethylphenyl)-2-[4-[(3S)-1-(2-methylpropanoyl)piperidine-3-carbonyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2-ethylphenyl)-2-[4-[(3S)-1-isobutyrylnipecotoyl]piperazin-1-ium-1-yl]acetamide Formula: C24H37N4O3+ MolecularWeight: 429.57558

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)C(=O)C3CCCN(C3)C(=O)C(C)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)C(=O)[C@H]3CCCN(C3)C(=O)C(C)C

InChI

InChI=1S/C24H36N4O3/c1-4-19-8-5-6-10-21(19)25-22(29)17-26-12-14-27(15-13-26)24(31)20-9-7-11-28(16-20)23(30)18(2)3/h5-6,8,10,18,20H,4,7,9,11-17H2,1-3H3,(H,25,29)/p+1/t20-/m0/s1