2-[2-methyl-9,10-bis(oxidanylidene)anthracen-1-yl]-1,3-bis(oxidanylidene)benzo[de]isoquinoline-6-carboxylic acid

Systemtic Name: 2-[2-methyl-9,10-bis(oxidanylidene)anthracen-1-yl]-1,3-bis(oxidanylidene)benzo[de]isoquinoline-6-carboxylic acid Openeye Name: 2-(2-methyl-9,10-dioxo-1-anthryl)-1,3-dioxo-benzo[de]isoquinoline-6-carboxylic acid CAS Name: 2-(2-methyl-9,10-dioxo-1-anthracenyl)-1,3-dioxo-6-benzo[de]isoquinolinecarboxylic acid IUPAC Name: 2-(2-methyl-9,10-dioxoanthracen-1-yl)-1,3-dioxobenzo[de]isoquinoline-6-carboxylic acid Traditional Name: 2-(9,10-diketo-2-methyl-1-anthryl)-1,3-diketo-benzo[de]isoquinoline-6-carboxylic acid Formula: C28H15NO6 MolecularWeight: 461.4218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)N4C(=O)C5=C6C(=C(C=C5)C(=O)O)C=CC=C6C4=O

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)N4C(=O)C5=C6C(=C(C=C5)C(=O)O)C=CC=C6C4=O

InChI

InChI=1S/C28H15NO6/c1-13-9-10-18-22(25(31)16-6-3-2-5-15(16)24(18)30)23(13)29-26(32)19-8-4-7-14-17(28(34)35)11-12-20(21(14)19)27(29)33/h2-12H,1H3,(H,34,35)