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

Systemtic Name: N-[9,10-bis(oxidanylidene)anthracen-1-yl]-2-[4-(naphthalen-1-ylmethyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(9,10-dioxo-1-anthryl)-2-[4-(1-naphthylmethyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(9,10-dioxo-1-anthracenyl)-2-[4-(1-naphthalenylmethyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(9,10-dioxoanthracen-1-yl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(9,10-diketo-1-anthryl)-2-[4-(1-naphthylmethyl)piperazin-1-ium-1-yl]acetamide Formula: C31H28N3O3+ MolecularWeight: 490.57232

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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)CC5=CC=CC6=CC=CC=C65

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O)CC5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C31H27N3O3/c35-28(32-27-14-6-13-26-29(27)31(37)25-12-4-3-11-24(25)30(26)36)20-34-17-15-33(16-18-34)19-22-9-5-8-21-7-1-2-10-23(21)22/h1-14H,15-20H2,(H,32,35)/p+1