1-adamantyl-[2-[[9,10-bis(oxidanylidene)anthracen-1-yl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: 1-adamantyl-[2-[[9,10-bis(oxidanylidene)anthracen-1-yl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: 1-adamantyl-[2-[(9,10-dioxo-1-anthryl)amino]-2-oxo-ethyl]ammonium CAS Name: 1-adamantyl-[2-[(9,10-dioxo-1-anthracenyl)amino]-2-oxoethyl]ammonium IUPAC Name: 1-adamantyl-[2-[(9,10-dioxoanthracen-1-yl)amino]-2-oxoethyl]azanium Traditional Name: 1-adamantyl-[2-[(9,10-diketo-1-anthryl)amino]-2-keto-ethyl]ammonium Formula: C26H27N2O3+ MolecularWeight: 415.50418

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)[NH2+]CC(=O)NC4=CC=CC5=C4C(=O)C6=CC=CC=C6C5=O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)[NH2+]CC(=O)NC4=CC=CC5=C4C(=O)C6=CC=CC=C6C5=O

InChI

InChI=1S/C26H26N2O3/c29-22(14-27-26-11-15-8-16(12-26)10-17(9-15)13-26)28-21-7-3-6-20-23(21)25(31)19-5-2-1-4-18(19)24(20)30/h1-7,15-17,27H,8-14H2,(H,28,29)/p+1