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

Systemtic Name: [(3S)-1-cyclopentylpiperidin-1-ium-3-yl]-(3-methoxyphenyl)methanone Openeye Name: [(3S)-1-cyclopentylpiperidin-1-ium-3-yl]-(3-methoxyphenyl)methanone CAS Name: [(3S)-1-cyclopentyl-3-piperidin-1-iumyl]-(3-methoxyphenyl)methanone IUPAC Name: [(3S)-1-cyclopentylpiperidin-1-ium-3-yl]-(3-methoxyphenyl)methanone Traditional Name: [(3S)-1-cyclopentylpiperidin-1-ium-3-yl]-(3-methoxyphenyl)methanone Formula: C18H26NO2+ MolecularWeight: 288.40454

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)C2CCC[NH+](C2)C3CCCC3

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)[C@H]2CCC[NH+](C2)C3CCCC3

InChI

InChI=1S/C18H25NO2/c1-21-17-10-4-6-14(12-17)18(20)15-7-5-11-19(13-15)16-8-2-3-9-16/h4,6,10,12,15-16H,2-3,5,7-9,11,13H2,1H3/p+1/t15-/m0/s1