(2R)-2-[(3-methyl-4-propan-2-yl-phenoxy)methyl]piperidin-1-ium

Systemtic Name: (2R)-2-[(3-methyl-4-propan-2-yl-phenoxy)methyl]piperidin-1-ium Openeye Name: (2R)-2-[(4-isopropyl-3-methyl-phenoxy)methyl]piperidin-1-ium CAS Name: (2R)-2-[(3-methyl-4-propan-2-ylphenoxy)methyl]piperidin-1-ium IUPAC Name: (2R)-2-[(3-methyl-4-propan-2-ylphenoxy)methyl]piperidin-1-ium Traditional Name: (2R)-2-[(4-isopropyl-3-methyl-phenoxy)methyl]piperidin-1-ium Formula: C16H26NO+ MolecularWeight: 248.38374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2CCCC[NH2+]2)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OC[C@H]2CCCC[NH2+]2)C(C)C

InChI

InChI=1S/C16H25NO/c1-12(2)16-8-7-15(10-13(16)3)18-11-14-6-4-5-9-17-14/h7-8,10,12,14,17H,4-6,9,11H2,1-3H3/p+1/t14-/m1/s1