[(3S)-1-cyclobutylpiperidin-1-ium-3-yl]-(3-methoxyphenyl)methanone

Systemtic Name: [(3S)-1-cyclobutylpiperidin-1-ium-3-yl]-(3-methoxyphenyl)methanone Openeye Name: [(3S)-1-cyclobutylpiperidin-1-ium-3-yl]-(3-methoxyphenyl)methanone CAS Name: [(3S)-1-cyclobutyl-3-piperidin-1-iumyl]-(3-methoxyphenyl)methanone IUPAC Name: [(3S)-1-cyclobutylpiperidin-1-ium-3-yl]-(3-methoxyphenyl)methanone Traditional Name: [(3S)-1-cyclobutylpiperidin-1-ium-3-yl]-(3-methoxyphenyl)methanone Formula: C17H24NO2+ MolecularWeight: 274.37796

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)C2CCC[NH+](C2)C3CCC3

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)[C@H]2CCC[NH+](C2)C3CCC3

InChI

InChI=1S/C17H23NO2/c1-20-16-9-2-5-13(11-16)17(19)14-6-4-10-18(12-14)15-7-3-8-15/h2,5,9,11,14-15H,3-4,6-8,10,12H2,1H3/p+1/t14-/m0/s1