2-[[9,10-bis(oxidanylidene)anthracen-2-yl]carbamoyl]-6-nitro-benzoic acid

Systemtic Name: 2-[[9,10-bis(oxidanylidene)anthracen-2-yl]carbamoyl]-6-nitro-benzoic acid Openeye Name: 2-[(9,10-dioxo-2-anthryl)carbamoyl]-6-nitro-benzoic acid CAS Name: 2-[[(9,10-dioxo-2-anthracenyl)amino]-oxomethyl]-6-nitrobenzoic acid IUPAC Name: 2-[(9,10-dioxoanthracen-2-yl)carbamoyl]-6-nitrobenzoic acid Traditional Name: 2-[(9,10-diketo-2-anthryl)carbamoyl]-6-nitro-benzoic acid Formula: C22H12N2O7 MolecularWeight: 416.33988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)NC(=O)C4=C(C(=CC=C4)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)NC(=O)C4=C(C(=CC=C4)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C22H12N2O7/c25-19-12-4-1-2-5-13(12)20(26)16-10-11(8-9-14(16)19)23-21(27)15-6-3-7-17(24(30)31)18(15)22(28)29/h1-10H,(H,23,27)(H,28,29)