5-methyl-2-oxidanyl-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 5-methyl-2-oxidanyl-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 2-hydroxy-5-methyl-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 2-hydroxy-5-methyl-N-[[4-(1-piperidin-1-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 2-hydroxy-5-methyl-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 2-hydroxy-5-methyl-N-[4-(piperidin-1-ium-1-ylmethyl)benzyl]benzamide Formula: C21H27N2O2+ MolecularWeight: 339.45128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)C(=O)NCC2=CC=C(C=C2)C[NH+]3CCCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)O)C(=O)NCC2=CC=C(C=C2)C[NH+]3CCCCC3

InChI

InChI=1S/C21H26N2O2/c1-16-5-10-20(24)19(13-16)21(25)22-14-17-6-8-18(9-7-17)15-23-11-3-2-4-12-23/h5-10,13,24H,2-4,11-12,14-15H2,1H3,(H,22,25)/p+1