[4-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]piperidin-1-yl]-(2-methoxyphenyl)methanone

Systemtic Name: [4-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]piperidin-1-yl]-(2-methoxyphenyl)methanone Openeye Name: [4-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]-1-piperidyl]-(2-methoxyphenyl)methanone CAS Name: [4-[(3S,5S)-3,5-dimethyl-1-piperidin-1-iumyl]-1-piperidinyl]-(2-methoxyphenyl)methanone IUPAC Name: [4-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]piperidin-1-yl]-(2-methoxyphenyl)methanone Traditional Name: [4-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]piperidino]-(2-methoxyphenyl)methanone Formula: C20H31N2O2+ MolecularWeight: 331.47234

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)C2CCN(CC2)C(=O)C3=CC=CC=C3OC)C

Isomeric SMILES

C[C@H]1C[C@@H](C[NH+](C1)C2CCN(CC2)C(=O)C3=CC=CC=C3OC)C

InChI

InChI=1S/C20H30N2O2/c1-15-12-16(2)14-22(13-15)17-8-10-21(11-9-17)20(23)18-6-4-5-7-19(18)24-3/h4-7,15-17H,8-14H2,1-3H3/p+1/t15-,16-/m0/s1