(3S)-1-[(2-oxidanylnaphthalen-1-yl)methyl]-N-phenyl-piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-1-[(2-oxidanylnaphthalen-1-yl)methyl]-N-phenyl-piperidin-1-ium-3-carboxamide Openeye Name: (3S)-1-[(2-hydroxy-1-naphthyl)methyl]-N-phenyl-piperidin-1-ium-3-carboxamide CAS Name: (3S)-1-[(2-hydroxy-1-naphthalenyl)methyl]-N-phenyl-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-1-[(2-hydroxynaphthalen-1-yl)methyl]-N-phenylpiperidin-1-ium-3-carboxamide Traditional Name: (3S)-1-[(2-hydroxy-1-naphthyl)methyl]-N-phenyl-piperidin-1-ium-3-carboxamide Formula: C23H25N2O2+ MolecularWeight: 361.4568

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=C(C=CC3=CC=CC=C32)O)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=C(C=CC3=CC=CC=C32)O)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C23H24N2O2/c26-22-13-12-17-7-4-5-11-20(17)21(22)16-25-14-6-8-18(15-25)23(27)24-19-9-2-1-3-10-19/h1-5,7,9-13,18,26H,6,8,14-16H2,(H,24,27)/p+1/t18-/m0/s1