4-[3-naphthalen-2-ylcarbonyl-4,6-bis(oxidanylidene)-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazol-5-yl]benzoic acid

Systemtic Name: 4-[3-naphthalen-2-ylcarbonyl-4,6-bis(oxidanylidene)-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazol-5-yl]benzoic acid Openeye Name: 4-[3-(naphthalene-2-carbonyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-d]isoxazol-5-yl]benzoic acid CAS Name: 4-[3-[2-naphthalenyl(oxo)methyl]-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-d]isoxazol-5-yl]benzoic acid IUPAC Name: 4-[3-(naphthalene-2-carbonyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazol-5-yl]benzoic acid Traditional Name: 4-[4,6-diketo-3-(2-naphthoyl)-3a,6a-dihydropyrrol[3,4-d]isoxazol-5-yl]benzoic acid Formula: C23H14N2O6 MolecularWeight: 414.36706

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C(=O)C3=NOC4C3C(=O)N(C4=O)C5=CC=C(C=C5)C(=O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C(=O)C3=NOC4C3C(=O)N(C4=O)C5=CC=C(C=C5)C(=O)O

InChI

InChI=1S/C23H14N2O6/c26-19(15-6-5-12-3-1-2-4-14(12)11-15)18-17-20(31-24-18)22(28)25(21(17)27)16-9-7-13(8-10-16)23(29)30/h1-11,17,20H,(H,29,30)