[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl 6-methanoyl-2,3-dimethoxy-benzoate

Systemtic Name: [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl 6-methanoyl-2,3-dimethoxy-benzoate Openeye Name: [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl 6-formyl-2,3-dimethoxy-benzoate CAS Name: 6-formyl-2,3-dimethoxybenzoic acid [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl 6-formyl-2,3-dimethoxybenzoate Traditional Name: 6-formyl-2,3-dimethoxy-benzoic acid [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C21H20N2O6 MolecularWeight: 396.3933

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NOC(=N2)COC(=O)C3=C(C=CC(=C3OC)OC)C=O

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NOC(=N2)COC(=O)C3=C(C=CC(=C3OC)OC)C=O

InChI

InChI=1S/C21H20N2O6/c1-4-13-5-7-14(8-6-13)20-22-17(29-23-20)12-28-21(25)18-15(11-24)9-10-16(26-2)19(18)27-3/h5-11H,4,12H2,1-3H3