(3S)-N-(4-phenylmethoxyphenyl)piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-N-(4-phenylmethoxyphenyl)piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N-(4-benzyloxyphenyl)piperidin-1-ium-3-carboxamide CAS Name: (3S)-N-(4-phenylmethoxyphenyl)-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N-(4-phenylmethoxyphenyl)piperidin-1-ium-3-carboxamide Traditional Name: (3S)-N-(4-benzoxyphenyl)piperidin-1-ium-3-carboxamide Formula: C19H23N2O2+ MolecularWeight: 311.39812

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH2+]C1)C(=O)NC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

C1C[C@@H](C[NH2+]C1)C(=O)NC2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C19H22N2O2/c22-19(16-7-4-12-20-13-16)21-17-8-10-18(11-9-17)23-14-15-5-2-1-3-6-15/h1-3,5-6,8-11,16,20H,4,7,12-14H2,(H,21,22)/p+1/t16-/m0/s1