2-[(dimethylazaniumyl)methyl]-6-methyl-3,8-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracen-1-olate

Systemtic Name: 2-[(dimethylazaniumyl)methyl]-6-methyl-3,8-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracen-1-olate Openeye Name: 2-[(dimethylammonio)methyl]-3,8-dihydroxy-6-methyl-9,10-dioxo-anthracen-1-olate CAS Name: 2-[(dimethylammonio)methyl]-3,8-dihydroxy-6-methyl-9,10-dioxo-1-anthracenolate IUPAC Name: 2-[(dimethylazaniumyl)methyl]-3,8-dihydroxy-6-methyl-9,10-dioxoanthracen-1-olate Traditional Name: 2-[(dimethylammonio)methyl]-3,8-dihydroxy-9,10-diketo-6-methyl-anthracen-1-olate Formula: C18H17NO5 MolecularWeight: 327.33128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=O)C3=CC(=C(C(=C3C2=O)[O-])C[NH+](C)C)O)O

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=O)C3=CC(=C(C(=C3C2=O)[O-])C[NH+](C)C)O)O

InChI

InChI=1S/C18H17NO5/c1-8-4-9-14(13(21)5-8)18(24)15-10(16(9)22)6-12(20)11(17(15)23)7-19(2)3/h4-6,20-21,23H,7H2,1-3H3