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

Systemtic Name: [(3S)-1-cyclobutylpiperidin-1-ium-3-yl]-(2,4-dimethoxyphenyl)methanone Openeye Name: [(3S)-1-cyclobutylpiperidin-1-ium-3-yl]-(2,4-dimethoxyphenyl)methanone CAS Name: [(3S)-1-cyclobutyl-3-piperidin-1-iumyl]-(2,4-dimethoxyphenyl)methanone IUPAC Name: [(3S)-1-cyclobutylpiperidin-1-ium-3-yl]-(2,4-dimethoxyphenyl)methanone Traditional Name: [(3S)-1-cyclobutylpiperidin-1-ium-3-yl]-(2,4-dimethoxyphenyl)methanone Formula: C18H26NO3+ MolecularWeight: 304.40394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25NO3/c1-21-15-8-9-16(17(11-15)22-2)18(20)13-5-4-10-19(12-13)14-6-3-7-14/h8-9,11,13-14H,3-7,10,12H2,1-2H3/p+1/t13-/m0/s1