1-(2,6-dimethyl-1H-indol-3-yl)-2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]ethanone

Systemtic Name: 1-(2,6-dimethyl-1H-indol-3-yl)-2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]ethanone Openeye Name: 1-(2,6-dimethyl-1H-indol-3-yl)-2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]ethanone CAS Name: 1-(2,6-dimethyl-1H-indol-3-yl)-2-[(3R,5R)-3,5-dimethyl-1-piperidin-1-iumyl]ethanone IUPAC Name: 1-(2,6-dimethyl-1H-indol-3-yl)-2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]ethanone Traditional Name: 1-(2,6-dimethyl-1H-indol-3-yl)-2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]ethanone Formula: C19H27N2O+ MolecularWeight: 299.43048

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CC(=O)C2=C(NC3=C2C=CC(=C3)C)C)C

Isomeric SMILES

C[C@@H]1C[C@H](C[NH+](C1)CC(=O)C2=C(NC3=C2C=CC(=C3)C)C)C

InChI

InChI=1S/C19H26N2O/c1-12-5-6-16-17(8-12)20-15(4)19(16)18(22)11-21-9-13(2)7-14(3)10-21/h5-6,8,13-14,20H,7,9-11H2,1-4H3/p+1/t13-,14-/m1/s1