(3S)-N-(2-tert-butylphenyl)piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-N-(2-tert-butylphenyl)piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N-(2-tert-butylphenyl)piperidin-1-ium-3-carboxamide CAS Name: (3S)-N-(2-tert-butylphenyl)-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N-(2-tert-butylphenyl)piperidin-1-ium-3-carboxamide Traditional Name: (3S)-N-(2-tert-butylphenyl)piperidin-1-ium-3-carboxamide Formula: C16H25N2O+ MolecularWeight: 261.3825

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1NC(=O)C2CCC[NH2+]C2

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1NC(=O)[C@H]2CCC[NH2+]C2

InChI

InChI=1S/C16H24N2O/c1-16(2,3)13-8-4-5-9-14(13)18-15(19)12-7-6-10-17-11-12/h4-5,8-9,12,17H,6-7,10-11H2,1-3H3,(H,18,19)/p+1/t12-/m0/s1