2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethanone

Systemtic Name: 2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethanone Openeye Name: 2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethanone CAS Name: 2-[4-[2-furanyl(oxo)methyl]-1-piperazin-1-iumyl]-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethanone IUPAC Name: 2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethanone Traditional Name: 2-[4-(2-furoyl)piperazin-1-ium-1-yl]-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethanone Formula: C21H24N3O4+ MolecularWeight: 382.43296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)C=CC(=C2)OC)C(=O)C[NH+]3CCN(CC3)C(=O)C4=CC=CO4

Isomeric SMILES

CC1=C(C2=C(N1)C=CC(=C2)OC)C(=O)C[NH+]3CCN(CC3)C(=O)C4=CC=CO4

InChI

InChI=1S/C21H23N3O4/c1-14-20(16-12-15(27-2)5-6-17(16)22-14)18(25)13-23-7-9-24(10-8-23)21(26)19-4-3-11-28-19/h3-6,11-12,22H,7-10,13H2,1-2H3/p+1