3-[[9,10-bis(oxidanylidene)anthracen-1-yl]sulfonylamino]benzoic acid

Systemtic Name: 3-[[9,10-bis(oxidanylidene)anthracen-1-yl]sulfonylamino]benzoic acid Openeye Name: 3-[(9,10-dioxo-1-anthryl)sulfonylamino]benzoic acid CAS Name: 3-[(9,10-dioxo-1-anthracenyl)sulfonylamino]benzoic acid IUPAC Name: 3-[(9,10-dioxoanthracen-1-yl)sulfonylamino]benzoic acid Traditional Name: 3-[(9,10-diketo-1-anthryl)sulfonylamino]benzoic acid Formula: C21H13NO6S MolecularWeight: 407.39602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)S(=O)(=O)NC4=CC=CC(=C4)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)S(=O)(=O)NC4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C21H13NO6S/c23-19-14-7-1-2-8-15(14)20(24)18-16(19)9-4-10-17(18)29(27,28)22-13-6-3-5-12(11-13)21(25)26/h1-11,22H,(H,25,26)