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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C[NH+]1CCN(CC1)C(=O)C2=CC3=C(C=C2)NC(=C3C)C

Isomeric SMILES

CCN(CC)C(=O)C[NH+]1CCN(CC1)C(=O)C2=CC3=C(C=C2)NC(=C3C)C

InChI

InChI=1S/C21H30N4O2/c1-5-24(6-2)20(26)14-23-9-11-25(12-10-23)21(27)17-7-8-19-18(13-17)15(3)16(4)22-19/h7-8,13,22H,5-6,9-12,14H2,1-4H3/p+1