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

Systemtic Name: (5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 3-nitrobenzoate Openeye Name: [5-methyl-2-(2-thienyl)oxazol-4-yl]methyl 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid (5-methyl-2-thiophen-2-yl-4-oxazolyl)methyl ester IUPAC Name: (5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [5-methyl-2-(2-thienyl)oxazol-4-yl]methyl ester Formula: C16H12N2O5S MolecularWeight: 344.34188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CS2)COC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CS2)COC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12N2O5S/c1-10-13(17-15(23-10)14-6-3-7-24-14)9-22-16(19)11-4-2-5-12(8-11)18(20)21/h2-8H,9H2,1H3