N-[(2S)-butan-2-yl]-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[(2S)-butan-2-yl]-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]-N-[(1S)-1-methylpropyl]acetamide CAS Name: N-[(2S)-butan-2-yl]-2-[4-(2-ethoxyphenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[(2S)-butan-2-yl]-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-[(1S)-1-methylpropyl]-2-(4-o-phenetylpiperazin-1-ium-1-yl)acetamide Formula: C18H30N3O2+ MolecularWeight: 320.4497

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C[NH+]1CCN(CC1)C2=CC=CC=C2OCC

Isomeric SMILES

CC[C@H](C)NC(=O)C[NH+]1CCN(CC1)C2=CC=CC=C2OCC

InChI

InChI=1S/C18H29N3O2/c1-4-15(3)19-18(22)14-20-10-12-21(13-11-20)16-8-6-7-9-17(16)23-5-2/h6-9,15H,4-5,10-14H2,1-3H3,(H,19,22)/p+1/t15-/m0/s1