ethyl 2-[2-[(5-nitro-2-oxidanyl-phenyl)carbonylamino]-1,3-thiazol-5-yl]ethanoate

Systemtic Name: ethyl 2-[2-[(5-nitro-2-oxidanyl-phenyl)carbonylamino]-1,3-thiazol-5-yl]ethanoate Openeye Name: ethyl 2-[2-[(2-hydroxy-5-nitro-benzoyl)amino]thiazol-5-yl]acetate CAS Name: 2-[2-[[(2-hydroxy-5-nitrophenyl)-oxomethyl]amino]-5-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[(2-hydroxy-5-nitrobenzoyl)amino]-1,3-thiazol-5-yl]acetate Traditional Name: 2-[2-[(2-hydroxy-5-nitro-benzoyl)amino]thiazol-5-yl]acetic acid ethyl ester Formula: C14H13N3O6S MolecularWeight: 351.33452

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CN=C(S1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])O

Isomeric SMILES

CCOC(=O)CC1=CN=C(S1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])O

InChI

InChI=1S/C14H13N3O6S/c1-2-23-12(19)6-9-7-15-14(24-9)16-13(20)10-5-8(17(21)22)3-4-11(10)18/h3-5,7,18H,2,6H2,1H3,(H,15,16,20)