methyl 4-[[2-(3-chlorophenyl)-1,3-oxazol-4-yl]methoxy]-3-nitro-benzoate

Systemtic Name: methyl 4-[[2-(3-chlorophenyl)-1,3-oxazol-4-yl]methoxy]-3-nitro-benzoate Openeye Name: methyl 4-[[2-(3-chlorophenyl)oxazol-4-yl]methoxy]-3-nitro-benzoate CAS Name: 4-[[2-(3-chlorophenyl)-4-oxazolyl]methoxy]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-[[2-(3-chlorophenyl)-1,3-oxazol-4-yl]methoxy]-3-nitrobenzoate Traditional Name: 4-[[2-(3-chlorophenyl)oxazol-4-yl]methoxy]-3-nitro-benzoic acid methyl ester Formula: C18H13ClN2O6 MolecularWeight: 388.75862

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)OCC2=COC(=N2)C3=CC(=CC=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)OCC2=COC(=N2)C3=CC(=CC=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H13ClN2O6/c1-25-18(22)12-5-6-16(15(8-12)21(23)24)26-9-14-10-27-17(20-14)11-3-2-4-13(19)7-11/h2-8,10H,9H2,1H3