N-[4-[[[1-(phenylmethyl)piperidin-1-ium-4-yl]carbamoylamino]methyl]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[4-[[[1-(phenylmethyl)piperidin-1-ium-4-yl]carbamoylamino]methyl]phenyl]cyclopropanecarboxamide Openeye Name: N-[4-[[(1-benzylpiperidin-1-ium-4-yl)carbamoylamino]methyl]phenyl]cyclopropanecarboxamide CAS Name: N-[4-[[[oxo-[[1-(phenylmethyl)-4-piperidin-1-iumyl]amino]methyl]amino]methyl]phenyl]cyclopropanecarboxamide IUPAC Name: N-[4-[[(1-benzylpiperidin-1-ium-4-yl)carbamoylamino]methyl]phenyl]cyclopropanecarboxamide Traditional Name: N-[4-[[(1-benzylpiperidin-1-ium-4-yl)carbamoylamino]methyl]phenyl]cyclopropanecarboxamide Formula: C24H31N4O2+ MolecularWeight: 407.52854

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC=C(C=C2)CNC(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CC1C(=O)NC2=CC=C(C=C2)CNC(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C24H30N4O2/c29-23(20-8-9-20)26-21-10-6-18(7-11-21)16-25-24(30)27-22-12-14-28(15-13-22)17-19-4-2-1-3-5-19/h1-7,10-11,20,22H,8-9,12-17H2,(H,26,29)(H2,25,27,30)/p+1