(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 2-methoxy-5-nitro-benzoate

Systemtic Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 2-methoxy-5-nitro-benzoate Openeye Name: [2-(3-thienyl)thiazol-4-yl]methyl 2-methoxy-5-nitro-benzoate CAS Name: 2-methoxy-5-nitrobenzoic acid [2-(3-thiophenyl)-4-thiazolyl]methyl ester IUPAC Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 2-methoxy-5-nitrobenzoate Traditional Name: 2-methoxy-5-nitro-benzoic acid [2-(3-thienyl)thiazol-4-yl]methyl ester Formula: C16H12N2O5S2 MolecularWeight: 376.40688

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=CSC(=N2)C3=CSC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=CSC(=N2)C3=CSC=C3

InChI

InChI=1S/C16H12N2O5S2/c1-22-14-3-2-12(18(20)21)6-13(14)16(19)23-7-11-9-25-15(17-11)10-4-5-24-8-10/h2-6,8-9H,7H2,1H3