(3R)-1-[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3R)-1-[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]piperidin-1-ium-3-carboxamide Openeye Name: (3R)-1-[2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl]piperidin-1-ium-3-carboxamide CAS Name: (3R)-1-[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-1-[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]piperidin-1-ium-3-carboxamide Traditional Name: (3R)-1-[2-keto-2-(2-methyl-1H-indol-3-yl)ethyl]piperidin-1-ium-3-carboxamide Formula: C17H22N3O2+ MolecularWeight: 300.37548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)C[NH+]3CCCC(C3)C(=O)N

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)C[NH+]3CCC[C@H](C3)C(=O)N

InChI

InChI=1S/C17H21N3O2/c1-11-16(13-6-2-3-7-14(13)19-11)15(21)10-20-8-4-5-12(9-20)17(18)22/h2-3,6-7,12,19H,4-5,8-10H2,1H3,(H2,18,22)/p+1/t12-/m1/s1