(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 3-nitrobenzoate

Systemtic Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 3-nitrobenzoate Openeye Name: [2-(3-thienyl)thiazol-4-yl]methyl 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [2-(3-thiophenyl)-4-thiazolyl]methyl ester IUPAC Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [2-(3-thienyl)thiazol-4-yl]methyl ester Formula: C15H10N2O4S2 MolecularWeight: 346.3809

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H10N2O4S2/c18-15(10-2-1-3-13(6-10)17(19)20)21-7-12-9-23-14(16-12)11-4-5-22-8-11/h1-6,8-9H,7H2