(4-methoxy-3-methyl-phenyl)-[(2S)-piperidin-1-ium-2-yl]methanone

Systemtic Name: (4-methoxy-3-methyl-phenyl)-[(2S)-piperidin-1-ium-2-yl]methanone Openeye Name: (4-methoxy-3-methyl-phenyl)-[(2S)-piperidin-1-ium-2-yl]methanone CAS Name: (4-methoxy-3-methylphenyl)-[(2S)-2-piperidin-1-iumyl]methanone IUPAC Name: (4-methoxy-3-methylphenyl)-[(2S)-piperidin-1-ium-2-yl]methanone Traditional Name: (4-methoxy-3-methyl-phenyl)-[(2S)-piperidin-1-ium-2-yl]methanone Formula: C14H20NO2+ MolecularWeight: 234.3141

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)C2CCCC[NH2+]2)OC

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO2/c1-10-9-11(6-7-13(10)17-2)14(16)12-5-3-4-8-15-12/h6-7,9,12,15H,3-5,8H2,1-2H3/p+1/t12-/m0/s1