N-[9,10-bis(oxidanylidene)anthracen-1-yl]-2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[9,10-bis(oxidanylidene)anthracen-1-yl]-2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(9,10-dioxo-1-anthryl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(9,10-dioxo-1-anthracenyl)-2-[4-[2-furanyl(oxo)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(9,10-dioxoanthracen-1-yl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(9,10-diketo-1-anthryl)-2-[4-(2-furoyl)piperazin-1-ium-1-yl]acetamide Formula: C25H22N3O5+ MolecularWeight: 444.45928

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O)C(=O)C5=CC=CO5

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O)C(=O)C5=CC=CO5

InChI

InChI=1S/C25H21N3O5/c29-21(15-27-10-12-28(13-11-27)25(32)20-9-4-14-33-20)26-19-8-3-7-18-22(19)24(31)17-6-2-1-5-16(17)23(18)30/h1-9,14H,10-13,15H2,(H,26,29)/p+1