[2-methoxy-4-[[2-(4-methyl-3-nitro-phenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]phenyl] propanoate

Systemtic Name: [2-methoxy-4-[[2-(4-methyl-3-nitro-phenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]phenyl] propanoate Openeye Name: [2-methoxy-4-[[2-(4-methyl-3-nitro-phenyl)-5-oxo-oxazol-4-ylidene]methyl]phenyl] propanoate CAS Name: propanoic acid [2-methoxy-4-[[2-(4-methyl-3-nitrophenyl)-5-oxo-4-oxazolylidene]methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[[2-(4-methyl-3-nitrophenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]phenyl] propanoate Traditional Name: propionic acid [4-[[5-keto-2-(4-methyl-3-nitro-phenyl)-2-oxazolin-4-ylidene]methyl]-2-methoxy-phenyl] ester Formula: C21H18N2O7 MolecularWeight: 410.37682

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=C(C=C(C=C1)C=C2C(=O)OC(=N2)C3=CC(=C(C=C3)C)[N+](=O)[O-])OC

Isomeric SMILES

CCC(=O)OC1=C(C=C(C=C1)C=C2C(=O)OC(=N2)C3=CC(=C(C=C3)C)[N+](=O)[O-])OC

InChI

InChI=1S/C21H18N2O7/c1-4-19(24)29-17-8-6-13(10-18(17)28-3)9-15-21(25)30-20(22-15)14-7-5-12(2)16(11-14)23(26)27/h5-11H,4H2,1-3H3