2-[(2R)-1-(2,3-dihydro-1H-inden-2-yl)-3-oxidanylidene-piperazin-1-ium-2-yl]-N-[(5-methoxy-1H-indol-2-yl)methyl]ethanamide

Systemtic Name: 2-[(2R)-1-(2,3-dihydro-1H-inden-2-yl)-3-oxidanylidene-piperazin-1-ium-2-yl]-N-[(5-methoxy-1H-indol-2-yl)methyl]ethanamide Openeye Name: 2-[(2R)-1-indan-2-yl-3-oxo-piperazin-1-ium-2-yl]-N-[(5-methoxy-1H-indol-2-yl)methyl]acetamide CAS Name: 2-[(2R)-1-(2,3-dihydro-1H-inden-2-yl)-3-oxo-2-piperazin-1-iumyl]-N-[(5-methoxy-1H-indol-2-yl)methyl]acetamide IUPAC Name: 2-[(2R)-1-(2,3-dihydro-1H-inden-2-yl)-3-oxopiperazin-1-ium-2-yl]-N-[(5-methoxy-1H-indol-2-yl)methyl]acetamide Traditional Name: 2-[(2R)-1-indan-2-yl-3-keto-piperazin-1-ium-2-yl]-N-[(5-methoxy-1H-indol-2-yl)methyl]acetamide Formula: C25H29N4O3+ MolecularWeight: 433.52276

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC(=C2)CNC(=O)CC3C(=O)NCC[NH+]3C4CC5=CC=CC=C5C4

Isomeric SMILES

COC1=CC2=C(C=C1)NC(=C2)CNC(=O)C[C@@H]3C(=O)NCC[NH+]3C4CC5=CC=CC=C5C4

InChI

InChI=1S/C25H28N4O3/c1-32-21-6-7-22-18(13-21)10-19(28-22)15-27-24(30)14-23-25(31)26-8-9-29(23)20-11-16-4-2-3-5-17(16)12-20/h2-7,10,13,20,23,28H,8-9,11-12,14-15H2,1H3,(H,26,31)(H,27,30)/p+1/t23-/m1/s1