(3S,6S)-6-methyl-N-(2-methyl-6-propan-2-yl-phenyl)piperidin-1-ium-3-carboxamide

Systemtic Name: (3S,6S)-6-methyl-N-(2-methyl-6-propan-2-yl-phenyl)piperidin-1-ium-3-carboxamide Openeye Name: (3S,6S)-N-(2-isopropyl-6-methyl-phenyl)-6-methyl-piperidin-1-ium-3-carboxamide CAS Name: (3S,6S)-6-methyl-N-(2-methyl-6-propan-2-ylphenyl)-3-piperidin-1-iumcarboxamide IUPAC Name: (3S,6S)-6-methyl-N-(2-methyl-6-propan-2-ylphenyl)piperidin-1-ium-3-carboxamide Traditional Name: (3S,6S)-N-(2-isopropyl-6-methyl-phenyl)-6-methyl-piperidin-1-ium-3-carboxamide Formula: C17H27N2O+ MolecularWeight: 275.40908

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C[NH2+]1)C(=O)NC2=C(C=CC=C2C(C)C)C

Isomeric SMILES

C[C@H]1CC[C@@H](C[NH2+]1)C(=O)NC2=C(C=CC=C2C(C)C)C

InChI

InChI=1S/C17H26N2O/c1-11(2)15-7-5-6-12(3)16(15)19-17(20)14-9-8-13(4)18-10-14/h5-7,11,13-14,18H,8-10H2,1-4H3,(H,19,20)/p+1/t13-,14-/m0/s1