N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-4-oxidanylidene-N-phenethyl-pentanamide

Systemtic Name: N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-4-oxidanylidene-N-phenethyl-pentanamide Openeye Name: N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-4-oxo-N-phenethyl-pentanamide CAS Name: N-[[(3R)-1-methyl-3-piperidin-1-iumyl]methyl]-4-oxo-N-phenethylpentanamide IUPAC Name: N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-4-oxo-N-phenethylpentanamide Traditional Name: 4-keto-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-N-phenethyl-valeramide Formula: C20H31N2O2+ MolecularWeight: 331.47234

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(=O)N(CCC1=CC=CC=C1)CC2CCC[NH+](C2)C

Isomeric SMILES

CC(=O)CCC(=O)N(CCC1=CC=CC=C1)C[C@H]2CCC[NH+](C2)C

InChI

InChI=1S/C20H30N2O2/c1-17(23)10-11-20(24)22(14-12-18-7-4-3-5-8-18)16-19-9-6-13-21(2)15-19/h3-5,7-8,19H,6,9-16H2,1-2H3/p+1/t19-/m0/s1