N-(3,5-dimethylphenyl)-3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propanamide

Systemtic Name: N-(3,5-dimethylphenyl)-3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propanamide Openeye Name: N-(3,5-dimethylphenyl)-3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propanamide CAS Name: N-(3,5-dimethylphenyl)-3-[(3R,5R)-3,5-dimethyl-1-piperidin-1-iumyl]propanamide IUPAC Name: N-(3,5-dimethylphenyl)-3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propanamide Traditional Name: N-(3,5-dimethylphenyl)-3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propionamide Formula: C18H29N2O+ MolecularWeight: 289.43566

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CCC(=O)NC2=CC(=CC(=C2)C)C)C

Isomeric SMILES

C[C@@H]1C[C@H](C[NH+](C1)CCC(=O)NC2=CC(=CC(=C2)C)C)C

InChI

InChI=1S/C18H28N2O/c1-13-7-14(2)10-17(9-13)19-18(21)5-6-20-11-15(3)8-16(4)12-20/h7,9-10,15-16H,5-6,8,11-12H2,1-4H3,(H,19,21)/p+1/t15-,16-/m1/s1