2-[2-(3-ethyl-5-methyl-1,2-oxazol-4-yl)-1,1-dimethyl-indol-1-ium-3-yl]ethanamide

Systemtic Name: 2-[2-(3-ethyl-5-methyl-1,2-oxazol-4-yl)-1,1-dimethyl-indol-1-ium-3-yl]ethanamide Openeye Name: 2-[2-(3-ethyl-5-methyl-isoxazol-4-yl)-1,1-dimethyl-indol-1-ium-3-yl]acetamide CAS Name: 2-[2-(3-ethyl-5-methyl-4-isoxazolyl)-1,1-dimethyl-3-indol-1-iumyl]acetamide IUPAC Name: 2-[2-(3-ethyl-5-methyl-1,2-oxazol-4-yl)-1,1-dimethylindol-1-ium-3-yl]acetamide Traditional Name: 2-[2-(3-ethyl-5-methyl-isoxazol-4-yl)-1,1-dimethyl-indol-1-ium-3-yl]acetamide Formula: C18H22N3O2+ MolecularWeight: 312.38618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=C1C2=C(C3=CC=CC=C3[N+]2(C)C)CC(=O)N)C

Isomeric SMILES

CCC1=NOC(=C1C2=C(C3=CC=CC=C3[N+]2(C)C)CC(=O)N)C

InChI

InChI=1S/C18H21N3O2/c1-5-14-17(11(2)23-20-14)18-13(10-16(19)22)12-8-6-7-9-15(12)21(18,3)4/h6-9H,5,10H2,1-4H3,(H-,19,22)/p+1