methyl 2-[4-(2-methylpropoxy)-3-nitro-phenyl]-1,3-benzoxazole-7-carboxylate

Systemtic Name: methyl 2-[4-(2-methylpropoxy)-3-nitro-phenyl]-1,3-benzoxazole-7-carboxylate Openeye Name: methyl 2-(4-isobutoxy-3-nitro-phenyl)-1,3-benzoxazole-7-carboxylate CAS Name: 2-[4-(2-methylpropoxy)-3-nitrophenyl]-1,3-benzoxazole-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[4-(2-methylpropoxy)-3-nitrophenyl]-1,3-benzoxazole-7-carboxylate Traditional Name: 2-(4-isobutoxy-3-nitro-phenyl)-1,3-benzoxazole-7-carboxylic acid methyl ester Formula: C19H18N2O6 MolecularWeight: 370.35602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C2=NC3=CC=CC(=C3O2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)C2=NC3=CC=CC(=C3O2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C19H18N2O6/c1-11(2)10-26-16-8-7-12(9-15(16)21(23)24)18-20-14-6-4-5-13(17(14)27-18)19(22)25-3/h4-9,11H,10H2,1-3H3