2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-1-(5-methoxy-1H-indol-3-yl)ethanone

Systemtic Name: 2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-1-(5-methoxy-1H-indol-3-yl)ethanone Openeye Name: 2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-1-(5-methoxy-1H-indol-3-yl)ethanone CAS Name: 2-[(3R,5R)-3,5-dimethyl-1-piperidin-1-iumyl]-1-(5-methoxy-1H-indol-3-yl)ethanone IUPAC Name: 2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-1-(5-methoxy-1H-indol-3-yl)ethanone Traditional Name: 2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-1-(5-methoxy-1H-indol-3-yl)ethanone Formula: C18H25N2O2+ MolecularWeight: 301.4033

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CC(=O)C2=CNC3=C2C=C(C=C3)OC)C

Isomeric SMILES

C[C@@H]1C[C@H](C[NH+](C1)CC(=O)C2=CNC3=C2C=C(C=C3)OC)C

InChI

InChI=1S/C18H24N2O2/c1-12-6-13(2)10-20(9-12)11-18(21)16-8-19-17-5-4-14(22-3)7-15(16)17/h4-5,7-8,12-13,19H,6,9-11H2,1-3H3/p+1/t12-,13-/m1/s1