(2R)-1-(1-adamantyl)-N-(2,4,6-trimethylphenyl)piperidin-1-ium-2-carboxamide

Systemtic Name: (2R)-1-(1-adamantyl)-N-(2,4,6-trimethylphenyl)piperidin-1-ium-2-carboxamide Openeye Name: (2R)-1-(1-adamantyl)-N-(2,4,6-trimethylphenyl)piperidin-1-ium-2-carboxamide CAS Name: (2R)-1-(1-adamantyl)-N-(2,4,6-trimethylphenyl)-2-piperidin-1-iumcarboxamide IUPAC Name: (2R)-1-(1-adamantyl)-N-(2,4,6-trimethylphenyl)piperidin-1-ium-2-carboxamide Traditional Name: (2R)-1-(1-adamantyl)-N-mesityl-piperidin-1-ium-2-carboxamide Formula: C25H37N2O+ MolecularWeight: 381.57408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C2CCCC[NH+]2C34CC5CC(C3)CC(C5)C4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)[C@H]2CCCC[NH+]2C34CC5CC(C3)CC(C5)C4)C

InChI

InChI=1S/C25H36N2O/c1-16-8-17(2)23(18(3)9-16)26-24(28)22-6-4-5-7-27(22)25-13-19-10-20(14-25)12-21(11-19)15-25/h8-9,19-22H,4-7,10-15H2,1-3H3,(H,26,28)/p+1/t19?,20?,21?,22-,25?/m1/s1