N1,N1,N4-trimethyl-N4-[(3S)-1-phenethylpiperidin-1-ium-3-yl]piperidine-1,4-dicarboxamide

Systemtic Name: N1,N1,N4-trimethyl-N4-[(3S)-1-phenethylpiperidin-1-ium-3-yl]piperidine-1,4-dicarboxamide Openeye Name: N1,N1,N4-trimethyl-N4-[(3S)-1-phenethylpiperidin-1-ium-3-yl]piperidine-1,4-dicarboxamide CAS Name: N1,N1,N4-trimethyl-N4-[(3S)-1-phenethyl-3-piperidin-1-iumyl]piperidine-1,4-dicarboxamide IUPAC Name: 1-N,1-N,4-N-trimethyl-4-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]piperidine-1,4-dicarboxamide Traditional Name: N,N,N'-trimethyl-N'-[(3S)-1-phenethylpiperidin-1-ium-3-yl]piperidine-1,4-dicarboxamide Formula: C23H37N4O2+ MolecularWeight: 401.56548

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)N1CCC(CC1)C(=O)N(C)C2CCC[NH+](C2)CCC3=CC=CC=C3

Isomeric SMILES

CN(C)C(=O)N1CCC(CC1)C(=O)N(C)[C@H]2CCC[NH+](C2)CCC3=CC=CC=C3

InChI

InChI=1S/C23H36N4O2/c1-24(2)23(29)27-16-12-20(13-17-27)22(28)25(3)21-10-7-14-26(18-21)15-11-19-8-5-4-6-9-19/h4-6,8-9,20-21H,7,10-18H2,1-3H3/p+1/t21-/m0/s1