N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]-2-[(2R)-3-oxidanylidene-1-phenethyl-piperazin-1-ium-2-yl]ethanamide

Systemtic Name: N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]-2-[(2R)-3-oxidanylidene-1-phenethyl-piperazin-1-ium-2-yl]ethanamide Openeye Name: N-[(1-methylindolin-5-yl)methyl]-2-[(2R)-3-oxo-1-phenethyl-piperazin-1-ium-2-yl]acetamide CAS Name: N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]-2-[(2R)-3-oxo-1-phenethyl-2-piperazin-1-iumyl]acetamide IUPAC Name: N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]-2-[(2R)-3-oxo-1-phenethylpiperazin-1-ium-2-yl]acetamide Traditional Name: 2-[(2R)-3-keto-1-phenethyl-piperazin-1-ium-2-yl]-N-[(1-methylindolin-5-yl)methyl]acetamide Formula: C24H31N4O2+ MolecularWeight: 407.52854

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C1C=CC(=C2)CNC(=O)CC3C(=O)NCC[NH+]3CCC4=CC=CC=C4

Isomeric SMILES

CN1CCC2=C1C=CC(=C2)CNC(=O)C[C@@H]3C(=O)NCC[NH+]3CCC4=CC=CC=C4

InChI

InChI=1S/C24H30N4O2/c1-27-12-10-20-15-19(7-8-21(20)27)17-26-23(29)16-22-24(30)25-11-14-28(22)13-9-18-5-3-2-4-6-18/h2-8,15,22H,9-14,16-17H2,1H3,(H,25,30)(H,26,29)/p+1/t22-/m1/s1