(5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-benzoate

Systemtic Name: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-benzoate Openeye Name: [5-(3-thienyl)-1,2,4-oxadiazol-3-yl]methyl 4-(2-amino-2-oxo-ethoxy)-3-methoxy-benzoate CAS Name: 4-(2-amino-2-oxoethoxy)-3-methoxybenzoic acid [5-(3-thiophenyl)-1,2,4-oxadiazol-3-yl]methyl ester IUPAC Name: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 4-(2-amino-2-oxoethoxy)-3-methoxybenzoate Traditional Name: 4-(2-amino-2-keto-ethoxy)-3-methoxy-benzoic acid [5-(3-thienyl)-1,2,4-oxadiazol-3-yl]methyl ester Formula: C17H15N3O6S MolecularWeight: 389.3825

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OCC2=NOC(=N2)C3=CSC=C3)OCC(=O)N

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OCC2=NOC(=N2)C3=CSC=C3)OCC(=O)N

InChI

InChI=1S/C17H15N3O6S/c1-23-13-6-10(2-3-12(13)24-7-14(18)21)17(22)25-8-15-19-16(26-20-15)11-4-5-27-9-11/h2-6,9H,7-8H2,1H3,(H2,18,21)