3,5-diacetamido-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 3,5-diacetamido-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 3,5-diacetamido-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 3,5-diacetamido-N-[[4-(1-piperidin-1-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 3,5-diacetamido-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 3,5-diacetamido-N-[4-(piperidin-1-ium-1-ylmethyl)benzyl]benzamide Formula: C24H31N4O3+ MolecularWeight: 423.52794

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC(=C1)C(=O)NCC2=CC=C(C=C2)C[NH+]3CCCCC3)NC(=O)C

Isomeric SMILES

CC(=O)NC1=CC(=CC(=C1)C(=O)NCC2=CC=C(C=C2)C[NH+]3CCCCC3)NC(=O)C

InChI

InChI=1S/C24H30N4O3/c1-17(29)26-22-12-21(13-23(14-22)27-18(2)30)24(31)25-15-19-6-8-20(9-7-19)16-28-10-4-3-5-11-28/h6-9,12-14H,3-5,10-11,15-16H2,1-2H3,(H,25,31)(H,26,29)(H,27,30)/p+1