[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 1,3-benzothiazole-6-carboxylate

Systemtic Name: [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 1,3-benzothiazole-6-carboxylate Openeye Name: [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 1,3-benzothiazole-6-carboxylate CAS Name: 1,3-benzothiazole-6-carboxylic acid [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 1,3-benzothiazole-6-carboxylate Traditional Name: 1,3-benzothiazole-6-carboxylic acid [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C17H10N4O5S MolecularWeight: 382.3501

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN=C(O2)COC(=O)C3=CC4=C(C=C3)N=CS4)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=NN=C(O2)COC(=O)C3=CC4=C(C=C3)N=CS4)[N+](=O)[O-]

InChI

InChI=1S/C17H10N4O5S/c22-17(11-3-6-13-14(7-11)27-9-18-13)25-8-15-19-20-16(26-15)10-1-4-12(5-2-10)21(23)24/h1-7,9H,8H2