[(3S)-1-cyclohexylpiperidin-1-ium-3-yl]-(2,4-dimethoxyphenyl)methanone

Systemtic Name: [(3S)-1-cyclohexylpiperidin-1-ium-3-yl]-(2,4-dimethoxyphenyl)methanone Openeye Name: [(3S)-1-cyclohexylpiperidin-1-ium-3-yl]-(2,4-dimethoxyphenyl)methanone CAS Name: [(3S)-1-cyclohexyl-3-piperidin-1-iumyl]-(2,4-dimethoxyphenyl)methanone IUPAC Name: [(3S)-1-cyclohexylpiperidin-1-ium-3-yl]-(2,4-dimethoxyphenyl)methanone Traditional Name: [(3S)-1-cyclohexylpiperidin-1-ium-3-yl]-(2,4-dimethoxyphenyl)methanone Formula: C20H30NO3+ MolecularWeight: 332.4571

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)C2CCC[NH+](C2)C3CCCCC3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)[C@H]2CCC[NH+](C2)C3CCCCC3)OC

InChI

InChI=1S/C20H29NO3/c1-23-17-10-11-18(19(13-17)24-2)20(22)15-7-6-12-21(14-15)16-8-4-3-5-9-16/h10-11,13,15-16H,3-9,12,14H2,1-2H3/p+1/t15-/m0/s1