(3S)-1-[(4-methoxy-2,3-dimethyl-phenyl)methyl]-3-methyl-piperidin-1-ium

Systemtic Name: (3S)-1-[(4-methoxy-2,3-dimethyl-phenyl)methyl]-3-methyl-piperidin-1-ium Openeye Name: (3S)-1-[(4-methoxy-2,3-dimethyl-phenyl)methyl]-3-methyl-piperidin-1-ium CAS Name: (3S)-1-[(4-methoxy-2,3-dimethylphenyl)methyl]-3-methylpiperidin-1-ium IUPAC Name: (3S)-1-[(4-methoxy-2,3-dimethylphenyl)methyl]-3-methylpiperidin-1-ium Traditional Name: (3S)-1-(4-methoxy-2,3-dimethyl-benzyl)-3-methyl-piperidin-1-ium Formula: C16H26NO+ MolecularWeight: 248.38374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC2=C(C(=C(C=C2)OC)C)C

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC2=C(C(=C(C=C2)OC)C)C

InChI

InChI=1S/C16H25NO/c1-12-6-5-9-17(10-12)11-15-7-8-16(18-4)14(3)13(15)2/h7-8,12H,5-6,9-11H2,1-4H3/p+1/t12-/m0/s1