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

Systemtic Name: N-[9,10-bis(oxidanylidene)anthracen-1-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(9,10-dioxo-1-anthryl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide CAS Name: N-(9,10-dioxo-1-anthracenyl)-2-(4-phenyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(9,10-dioxoanthracen-1-yl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(9,10-diketo-1-anthryl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Formula: C26H24N3O3+ MolecularWeight: 426.48706

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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)C5=CC=CC=C5

Isomeric SMILES

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

InChI

InChI=1S/C26H23N3O3/c30-23(17-28-13-15-29(16-14-28)18-7-2-1-3-8-18)27-22-12-6-11-21-24(22)26(32)20-10-5-4-9-19(20)25(21)31/h1-12H,13-17H2,(H,27,30)/p+1