O1-methyl O4-propan-2-yl 3-acetyloxy-5-methyl-2-nitro-benzene-1,4-dicarboxylate

Systemtic Name: O1-methyl O4-propan-2-yl 3-acetyloxy-5-methyl-2-nitro-benzene-1,4-dicarboxylate Openeye Name: O4-isopropyl O1-methyl 3-acetoxy-5-methyl-2-nitro-benzene-1,4-dicarboxylate CAS Name: 3-acetyloxy-5-methyl-2-nitrobenzene-1,4-dicarboxylic acid O1-methyl ester O4-propan-2-yl ester IUPAC Name: 1-O-methyl 4-O-propan-2-yl 3-acetyloxy-5-methyl-2-nitrobenzene-1,4-dicarboxylate Traditional Name: 3-acetoxy-5-methyl-2-nitro-benzene-1,4-dicarboxylic acid O4-isopropyl ester O1-methyl ester Formula: C15H17NO8 MolecularWeight: 339.29738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1)C(=O)OC)[N+](=O)[O-])OC(=O)C)C(=O)OC(C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1)C(=O)OC)[N+](=O)[O-])OC(=O)C)C(=O)OC(C)C

InChI

InChI=1S/C15H17NO8/c1-7(2)23-15(19)11-8(3)6-10(14(18)22-5)12(16(20)21)13(11)24-9(4)17/h6-7H,1-5H3