3-methoxy-N-[(5-nitro-2-oxidanyl-phenyl)methyl]-4-(1,3-thiazol-4-ylmethoxy)benzamide

Systemtic Name: 3-methoxy-N-[(5-nitro-2-oxidanyl-phenyl)methyl]-4-(1,3-thiazol-4-ylmethoxy)benzamide Openeye Name: N-[(2-hydroxy-5-nitro-phenyl)methyl]-3-methoxy-4-(thiazol-4-ylmethoxy)benzamide CAS Name: N-[(2-hydroxy-5-nitrophenyl)methyl]-3-methoxy-4-(4-thiazolylmethoxy)benzamide IUPAC Name: N-[(2-hydroxy-5-nitrophenyl)methyl]-3-methoxy-4-(1,3-thiazol-4-ylmethoxy)benzamide Traditional Name: N-(2-hydroxy-5-nitro-benzyl)-3-methoxy-4-(thiazol-4-ylmethoxy)benzamide Formula: C19H17N3O6S MolecularWeight: 415.41978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])O)OCC3=CSC=N3

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])O)OCC3=CSC=N3

InChI

InChI=1S/C19H17N3O6S/c1-27-18-7-12(2-5-17(18)28-9-14-10-29-11-21-14)19(24)20-8-13-6-15(22(25)26)3-4-16(13)23/h2-7,10-11,23H,8-9H2,1H3,(H,20,24)