2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-1-(5-methoxy-1,2-dimethyl-indol-3-yl)ethanone

Systemtic Name: 2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-1-(5-methoxy-1,2-dimethyl-indol-3-yl)ethanone Openeye Name: 2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-1-(5-methoxy-1,2-dimethyl-indol-3-yl)ethanone CAS Name: 2-[(2S)-2-ethyl-1-piperidin-1-iumyl]-1-(5-methoxy-1,2-dimethyl-3-indolyl)ethanone IUPAC Name: 2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-1-(5-methoxy-1,2-dimethylindol-3-yl)ethanone Traditional Name: 2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-1-(5-methoxy-1,2-dimethyl-indol-3-yl)ethanone Formula: C20H29N2O2+ MolecularWeight: 329.45646

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CC(=O)C2=C(N(C3=C2C=C(C=C3)OC)C)C

Isomeric SMILES

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

InChI

InChI=1S/C20H28N2O2/c1-5-15-8-6-7-11-22(15)13-19(23)20-14(2)21(3)18-10-9-16(24-4)12-17(18)20/h9-10,12,15H,5-8,11,13H2,1-4H3/p+1/t15-/m0/s1