(3S)-N-(2-propan-2-yloxyphenyl)piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-N-(2-propan-2-yloxyphenyl)piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N-(2-isopropoxyphenyl)piperidin-1-ium-3-carboxamide CAS Name: (3S)-N-(2-propan-2-yloxyphenyl)-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N-(2-propan-2-yloxyphenyl)piperidin-1-ium-3-carboxamide Traditional Name: (3S)-N-(2-isopropoxyphenyl)piperidin-1-ium-3-carboxamide Formula: C15H23N2O2+ MolecularWeight: 263.35532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC=C1NC(=O)C2CCC[NH2+]C2

Isomeric SMILES

CC(C)OC1=CC=CC=C1NC(=O)[C@H]2CCC[NH2+]C2

InChI

InChI=1S/C15H22N2O2/c1-11(2)19-14-8-4-3-7-13(14)17-15(18)12-6-5-9-16-10-12/h3-4,7-8,11-12,16H,5-6,9-10H2,1-2H3,(H,17,18)/p+1/t12-/m0/s1