(3S)-N-methyl-1-(naphthalen-1-ylmethyl)-N-(phenylmethyl)piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-N-methyl-1-(naphthalen-1-ylmethyl)-N-(phenylmethyl)piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N-benzyl-N-methyl-1-(1-naphthylmethyl)piperidin-1-ium-3-carboxamide CAS Name: (3S)-N-methyl-1-(1-naphthalenylmethyl)-N-(phenylmethyl)-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N-benzyl-N-methyl-1-(naphthalen-1-ylmethyl)piperidin-1-ium-3-carboxamide Traditional Name: (3S)-N-benzyl-N-methyl-1-(1-naphthylmethyl)piperidin-1-ium-3-carboxamide Formula: C25H29N2O+ MolecularWeight: 373.51056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)C2CCC[NH+](C2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)[C@H]2CCC[NH+](C2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H28N2O/c1-26(17-20-9-3-2-4-10-20)25(28)23-14-8-16-27(19-23)18-22-13-7-12-21-11-5-6-15-24(21)22/h2-7,9-13,15,23H,8,14,16-19H2,1H3/p+1/t23-/m0/s1