(3R)-1-[(4-ethylphenyl)methyl]-N-methyl-N-(phenylmethyl)piperidin-1-ium-3-carboxamide

Systemtic Name: (3R)-1-[(4-ethylphenyl)methyl]-N-methyl-N-(phenylmethyl)piperidin-1-ium-3-carboxamide Openeye Name: (3R)-N-benzyl-1-[(4-ethylphenyl)methyl]-N-methyl-piperidin-1-ium-3-carboxamide CAS Name: (3R)-1-[(4-ethylphenyl)methyl]-N-methyl-N-(phenylmethyl)-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-N-benzyl-1-[(4-ethylphenyl)methyl]-N-methylpiperidin-1-ium-3-carboxamide Traditional Name: (3R)-N-benzyl-1-(4-ethylbenzyl)-N-methyl-piperidin-1-ium-3-carboxamide Formula: C23H31N2O+ MolecularWeight: 351.50504

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH+]2CCCC(C2)C(=O)N(C)CC3=CC=CC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH+]2CCC[C@H](C2)C(=O)N(C)CC3=CC=CC=C3

InChI

InChI=1S/C23H30N2O/c1-3-19-11-13-21(14-12-19)17-25-15-7-10-22(18-25)23(26)24(2)16-20-8-5-4-6-9-20/h4-6,8-9,11-14,22H,3,7,10,15-18H2,1-2H3/p+1/t22-/m1/s1