(3S)-3-methyl-1-[4-(3-methyl-5-propan-2-yl-phenoxy)butyl]piperidin-1-ium

Systemtic Name: (3S)-3-methyl-1-[4-(3-methyl-5-propan-2-yl-phenoxy)butyl]piperidin-1-ium Openeye Name: (3S)-1-[4-(3-isopropyl-5-methyl-phenoxy)butyl]-3-methyl-piperidin-1-ium CAS Name: (3S)-3-methyl-1-[4-(3-methyl-5-propan-2-ylphenoxy)butyl]piperidin-1-ium IUPAC Name: (3S)-3-methyl-1-[4-(3-methyl-5-propan-2-ylphenoxy)butyl]piperidin-1-ium Traditional Name: (3S)-1-[4-(3-isopropyl-5-methyl-phenoxy)butyl]-3-methyl-piperidin-1-ium Formula: C20H34NO+ MolecularWeight: 304.49006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CCCCOC2=CC(=CC(=C2)C(C)C)C

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CCCCOC2=CC(=CC(=C2)C(C)C)C

InChI

InChI=1S/C20H33NO/c1-16(2)19-12-18(4)13-20(14-19)22-11-6-5-9-21-10-7-8-17(3)15-21/h12-14,16-17H,5-11,15H2,1-4H3/p+1/t17-/m0/s1