methyl 2-[(6aR)-3-(4-chlorophenyl)-4,6-bis(oxidanylidene)-2,6a-dihydropyrrolo[3,4-d][1,2]oxazol-5-yl]benzoate

Systemtic Name: methyl 2-[(6aR)-3-(4-chlorophenyl)-4,6-bis(oxidanylidene)-2,6a-dihydropyrrolo[3,4-d][1,2]oxazol-5-yl]benzoate Openeye Name: methyl 2-[(6aR)-3-(4-chlorophenyl)-4,6-dioxo-2,6a-dihydropyrrolo[3,4-d]isoxazol-5-yl]benzoate CAS Name: 2-[(6aR)-3-(4-chlorophenyl)-4,6-dioxo-2,6a-dihydropyrrolo[3,4-d]isoxazol-5-yl]benzoic acid methyl ester IUPAC Name: methyl 2-[(6aR)-3-(4-chlorophenyl)-4,6-dioxo-2,6a-dihydropyrrolo[3,4-d][1,2]oxazol-5-yl]benzoate Traditional Name: 2-[(6aR)-3-(4-chlorophenyl)-4,6-diketo-2,6a-dihydropyrrol[3,4-d]isoxazol-5-yl]benzoic acid methyl ester Formula: C19H13ClN2O5 MolecularWeight: 384.76992

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1N2C(=O)C3C(=C(NO3)C4=CC=C(C=C4)Cl)C2=O

Isomeric SMILES

COC(=O)C1=CC=CC=C1N2C(=O)[C@H]3C(=C(NO3)C4=CC=C(C=C4)Cl)C2=O

InChI

InChI=1S/C19H13ClN2O5/c1-26-19(25)12-4-2-3-5-13(12)22-17(23)14-15(21-27-16(14)18(22)24)10-6-8-11(20)9-7-10/h2-9,16,21H,1H3/t16-/m1/s1