N-methyl-2-[(2R)-1-(3-methylbut-2-enyl)-3-oxidanylidene-piperazin-1-ium-2-yl]-N-[(3-methyl-1H-indol-2-yl)methyl]ethanamide

Systemtic Name: N-methyl-2-[(2R)-1-(3-methylbut-2-enyl)-3-oxidanylidene-piperazin-1-ium-2-yl]-N-[(3-methyl-1H-indol-2-yl)methyl]ethanamide Openeye Name: N-methyl-2-[(2R)-1-(3-methylbut-2-enyl)-3-oxo-piperazin-1-ium-2-yl]-N-[(3-methyl-1H-indol-2-yl)methyl]acetamide CAS Name: N-methyl-2-[(2R)-1-(3-methylbut-2-enyl)-3-oxo-2-piperazin-1-iumyl]-N-[(3-methyl-1H-indol-2-yl)methyl]acetamide IUPAC Name: N-methyl-2-[(2R)-1-(3-methylbut-2-enyl)-3-oxopiperazin-1-ium-2-yl]-N-[(3-methyl-1H-indol-2-yl)methyl]acetamide Traditional Name: 2-[(2R)-3-keto-1-(3-methylbut-2-enyl)piperazin-1-ium-2-yl]-N-methyl-N-[(3-methyl-1H-indol-2-yl)methyl]acetamide Formula: C22H31N4O2+ MolecularWeight: 383.50714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=CC=CC=C12)CN(C)C(=O)CC3C(=O)NCC[NH+]3CC=C(C)C

Isomeric SMILES

CC1=C(NC2=CC=CC=C12)CN(C)C(=O)C[C@@H]3C(=O)NCC[NH+]3CC=C(C)C

InChI

InChI=1S/C22H30N4O2/c1-15(2)9-11-26-12-10-23-22(28)20(26)13-21(27)25(4)14-19-16(3)17-7-5-6-8-18(17)24-19/h5-9,20,24H,10-14H2,1-4H3,(H,23,28)/p+1/t20-/m1/s1