methyl 2-methyl-3-nitro-6-(2,3,6-trimethoxyphenyl)benzoate

Systemtic Name: methyl 2-methyl-3-nitro-6-(2,3,6-trimethoxyphenyl)benzoate Openeye Name: methyl 2-methyl-3-nitro-6-(2,3,6-trimethoxyphenyl)benzoate CAS Name: 2-methyl-3-nitro-6-(2,3,6-trimethoxyphenyl)benzoic acid methyl ester IUPAC Name: methyl 2-methyl-3-nitro-6-(2,3,6-trimethoxyphenyl)benzoate Traditional Name: 2-methyl-3-nitro-6-(2,3,6-trimethoxyphenyl)benzoic acid methyl ester Formula: C18H19NO7 MolecularWeight: 361.34596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C(=O)OC)C2=C(C=CC(=C2OC)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1C(=O)OC)C2=C(C=CC(=C2OC)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H19NO7/c1-10-12(19(21)22)7-6-11(15(10)18(20)26-5)16-13(23-2)8-9-14(24-3)17(16)25-4/h6-9H,1-5H3