[(3S)-1-cyclopentylpiperidin-1-ium-3-yl]-(3-propan-2-yloxyphenyl)methanone

Systemtic Name: [(3S)-1-cyclopentylpiperidin-1-ium-3-yl]-(3-propan-2-yloxyphenyl)methanone Openeye Name: [(3S)-1-cyclopentylpiperidin-1-ium-3-yl]-(3-isopropoxyphenyl)methanone CAS Name: [(3S)-1-cyclopentyl-3-piperidin-1-iumyl]-(3-propan-2-yloxyphenyl)methanone IUPAC Name: [(3S)-1-cyclopentylpiperidin-1-ium-3-yl]-(3-propan-2-yloxyphenyl)methanone Traditional Name: [(3S)-1-cyclopentylpiperidin-1-ium-3-yl]-(3-isopropoxyphenyl)methanone Formula: C20H30NO2+ MolecularWeight: 316.4577

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C(=O)C2CCC[NH+](C2)C3CCCC3

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C(=O)[C@H]2CCC[NH+](C2)C3CCCC3

InChI

InChI=1S/C20H29NO2/c1-15(2)23-19-11-5-7-16(13-19)20(22)17-8-6-12-21(14-17)18-9-3-4-10-18/h5,7,11,13,15,17-18H,3-4,6,8-10,12,14H2,1-2H3/p+1/t17-/m0/s1