2-[4-[(2,3-dimethyl-1H-indol-5-yl)carbonyl]piperazin-1-ium-1-yl]-N-(2-methylpropyl)ethanamide

Systemtic Name: 2-[4-[(2,3-dimethyl-1H-indol-5-yl)carbonyl]piperazin-1-ium-1-yl]-N-(2-methylpropyl)ethanamide Openeye Name: 2-[4-(2,3-dimethyl-1H-indole-5-carbonyl)piperazin-1-ium-1-yl]-N-isobutyl-acetamide CAS Name: 2-[4-[(2,3-dimethyl-1H-indol-5-yl)-oxomethyl]-1-piperazin-1-iumyl]-N-(2-methylpropyl)acetamide IUPAC Name: 2-[4-(2,3-dimethyl-1H-indole-5-carbonyl)piperazin-1-ium-1-yl]-N-(2-methylpropyl)acetamide Traditional Name: 2-[4-(2,3-dimethyl-1H-indole-5-carbonyl)piperazin-1-ium-1-yl]-N-isobutyl-acetamide Formula: C21H31N4O2+ MolecularWeight: 371.49644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=C(C=C2)C(=O)N3CC[NH+](CC3)CC(=O)NCC(C)C)C

Isomeric SMILES

CC1=C(NC2=C1C=C(C=C2)C(=O)N3CC[NH+](CC3)CC(=O)NCC(C)C)C

InChI

InChI=1S/C21H30N4O2/c1-14(2)12-22-20(26)13-24-7-9-25(10-8-24)21(27)17-5-6-19-18(11-17)15(3)16(4)23-19/h5-6,11,14,23H,7-10,12-13H2,1-4H3,(H,22,26)/p+1