[4-[5-(4-chlorophenyl)-4,6-bis(oxidanylidene)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]phenyl] 2-methylpyrazole-3-carboxylate

Systemtic Name: [4-[5-(4-chlorophenyl)-4,6-bis(oxidanylidene)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]phenyl] 2-methylpyrazole-3-carboxylate Openeye Name: [4-[5-(4-chlorophenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d]isoxazol-3-yl]phenyl] 2-methylpyrazole-3-carboxylate CAS Name: 2-methyl-3-pyrazolecarboxylic acid [4-[5-(4-chlorophenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d]isoxazol-3-yl]phenyl] ester IUPAC Name: [4-[5-(4-chlorophenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]phenyl] 2-methylpyrazole-3-carboxylate Traditional Name: 2-methylpyrazole-3-carboxylic acid [4-[5-(4-chlorophenyl)-4,6-diketo-2-phenyl-3a,6a-dihydro-3H-pyrrol[3,4-d]isoxazol-3-yl]phenyl] ester Formula: C28H21ClN4O5 MolecularWeight: 528.94314

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)C(=O)OC2=CC=C(C=C2)C3C4C(C(=O)N(C4=O)C5=CC=C(C=C5)Cl)ON3C6=CC=CC=C6

Isomeric SMILES

CN1C(=CC=N1)C(=O)OC2=CC=C(C=C2)C3C4C(C(=O)N(C4=O)C5=CC=C(C=C5)Cl)ON3C6=CC=CC=C6

InChI

InChI=1S/C28H21ClN4O5/c1-31-22(15-16-30-31)28(36)37-21-13-7-17(8-14-21)24-23-25(38-33(24)20-5-3-2-4-6-20)27(35)32(26(23)34)19-11-9-18(29)10-12-19/h2-16,23-25H,1H3