[3-(2-methoxyphenyl)-1,2-oxazol-5-yl]methyl 4-[1,1-bis(oxidanylidene)-1,2-thiazolidin-2-yl]benzoate

Systemtic Name: [3-(2-methoxyphenyl)-1,2-oxazol-5-yl]methyl 4-[1,1-bis(oxidanylidene)-1,2-thiazolidin-2-yl]benzoate Openeye Name: [3-(2-methoxyphenyl)isoxazol-5-yl]methyl 4-(1,1-dioxo-1,2-thiazolidin-2-yl)benzoate CAS Name: 4-(1,1-dioxo-1,2-thiazolidin-2-yl)benzoic acid [3-(2-methoxyphenyl)-5-isoxazolyl]methyl ester IUPAC Name: [3-(2-methoxyphenyl)-1,2-oxazol-5-yl]methyl 4-(1,1-dioxo-1,2-thiazolidin-2-yl)benzoate Traditional Name: 4-(1,1-diketo-1,2-thiazolidin-2-yl)benzoic acid [3-(2-methoxyphenyl)isoxazol-5-yl]methyl ester Formula: C21H20N2O6S MolecularWeight: 428.4583

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NOC(=C2)COC(=O)C3=CC=C(C=C3)N4CCCS4(=O)=O

Isomeric SMILES

COC1=CC=CC=C1C2=NOC(=C2)COC(=O)C3=CC=C(C=C3)N4CCCS4(=O)=O

InChI

InChI=1S/C21H20N2O6S/c1-27-20-6-3-2-5-18(20)19-13-17(29-22-19)14-28-21(24)15-7-9-16(10-8-15)23-11-4-12-30(23,25)26/h2-3,5-10,13H,4,11-12,14H2,1H3