(2-ethyl-1,3-thiazol-4-yl)methyl 3-methyl-4-nitro-benzoate

Systemtic Name: (2-ethyl-1,3-thiazol-4-yl)methyl 3-methyl-4-nitro-benzoate Openeye Name: (2-ethylthiazol-4-yl)methyl 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-nitrobenzoic acid (2-ethyl-4-thiazolyl)methyl ester IUPAC Name: (2-ethyl-1,3-thiazol-4-yl)methyl 3-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid (2-ethylthiazol-4-yl)methyl ester Formula: C14H14N2O4S MolecularWeight: 306.33696

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=CS1)COC(=O)C2=CC(=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCC1=NC(=CS1)COC(=O)C2=CC(=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C14H14N2O4S/c1-3-13-15-11(8-21-13)7-20-14(17)10-4-5-12(16(18)19)9(2)6-10/h4-6,8H,3,7H2,1-2H3