N-[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-4-nitro-3-oxidanyl-benzamide

Systemtic Name: N-[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-4-nitro-3-oxidanyl-benzamide Openeye Name: N-[4-(2,4-dimethoxyphenyl)thiazol-2-yl]-3-hydroxy-4-nitro-benzamide CAS Name: N-[4-(2,4-dimethoxyphenyl)-2-thiazolyl]-3-hydroxy-4-nitrobenzamide IUPAC Name: N-[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-hydroxy-4-nitrobenzamide Traditional Name: N-[4-(2,4-dimethoxyphenyl)thiazol-2-yl]-3-hydroxy-4-nitro-benzamide Formula: C18H15N3O6S MolecularWeight: 401.3932

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])O)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])O)OC

InChI

InChI=1S/C18H15N3O6S/c1-26-11-4-5-12(16(8-11)27-2)13-9-28-18(19-13)20-17(23)10-3-6-14(21(24)25)15(22)7-10/h3-9,22H,1-2H3,(H,19,20,23)