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

Systemtic Name: 2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]-1-(5-methoxy-1,2-dimethyl-indol-3-yl)ethanone Openeye Name: 2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]-1-(5-methoxy-1,2-dimethyl-indol-3-yl)ethanone CAS Name: 2-[4-[2-furanyl(oxo)methyl]-1-piperazin-1-iumyl]-1-(5-methoxy-1,2-dimethyl-3-indolyl)ethanone IUPAC Name: 2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]-1-(5-methoxy-1,2-dimethylindol-3-yl)ethanone Traditional Name: 2-[4-(2-furoyl)piperazin-1-ium-1-yl]-1-(5-methoxy-1,2-dimethyl-indol-3-yl)ethanone Formula: C22H26N3O4+ MolecularWeight: 396.45954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C)C=CC(=C2)OC)C(=O)C[NH+]3CCN(CC3)C(=O)C4=CC=CO4

Isomeric SMILES

CC1=C(C2=C(N1C)C=CC(=C2)OC)C(=O)C[NH+]3CCN(CC3)C(=O)C4=CC=CO4

InChI

InChI=1S/C22H25N3O4/c1-15-21(17-13-16(28-3)6-7-18(17)23(15)2)19(26)14-24-8-10-25(11-9-24)22(27)20-5-4-12-29-20/h4-7,12-13H,8-11,14H2,1-3H3/p+1