(2S)-1-(5-methoxy-1,2-dimethyl-indol-3-yl)-2-piperidin-1-ium-1-yl-propan-1-one

Systemtic Name: (2S)-1-(5-methoxy-1,2-dimethyl-indol-3-yl)-2-piperidin-1-ium-1-yl-propan-1-one Openeye Name: (2S)-1-(5-methoxy-1,2-dimethyl-indol-3-yl)-2-piperidin-1-ium-1-yl-propan-1-one CAS Name: (2S)-1-(5-methoxy-1,2-dimethyl-3-indolyl)-2-(1-piperidin-1-iumyl)-1-propanone IUPAC Name: (2S)-1-(5-methoxy-1,2-dimethylindol-3-yl)-2-piperidin-1-ium-1-ylpropan-1-one Traditional Name: (2S)-1-(5-methoxy-1,2-dimethyl-indol-3-yl)-2-piperidin-1-ium-1-yl-propan-1-one Formula: C19H27N2O2+ MolecularWeight: 315.42988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C)C=CC(=C2)OC)C(=O)C(C)[NH+]3CCCCC3

Isomeric SMILES

CC1=C(C2=C(N1C)C=CC(=C2)OC)C(=O)[C@H](C)[NH+]3CCCCC3

InChI

InChI=1S/C19H26N2O2/c1-13-18(19(22)14(2)21-10-6-5-7-11-21)16-12-15(23-4)8-9-17(16)20(13)3/h8-9,12,14H,5-7,10-11H2,1-4H3/p+1/t14-/m0/s1