dimethyl 3-(acetyloxymethyl)-5-[2-(2,2-dimethylpropanoylamino)-3-methoxy-3-oxidanylidene-propyl]benzene-1,2-dicarboxylate

Systemtic Name: dimethyl 3-(acetyloxymethyl)-5-[2-(2,2-dimethylpropanoylamino)-3-methoxy-3-oxidanylidene-propyl]benzene-1,2-dicarboxylate Openeye Name: dimethyl 3-(acetoxymethyl)-5-[2-(2,2-dimethylpropanoylamino)-3-methoxy-3-oxo-propyl]benzene-1,2-dicarboxylate CAS Name: 3-(acetyloxymethyl)-5-[2-[(2,2-dimethyl-1-oxopropyl)amino]-3-methoxy-3-oxopropyl]benzene-1,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-(acetyloxymethyl)-5-[2-(2,2-dimethylpropanoylamino)-3-methoxy-3-oxopropyl]benzene-1,2-dicarboxylate Traditional Name: 3-(acetoxymethyl)-5-[3-keto-3-methoxy-2-(pivaloylamino)propyl]benzene-1,2-dicarboxylic acid dimethyl ester Formula: C22H29NO9 MolecularWeight: 451.46696

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=C(C(=CC(=C1)CC(C(=O)OC)NC(=O)C(C)(C)C)C(=O)OC)C(=O)OC

Isomeric SMILES

CC(=O)OCC1=C(C(=CC(=C1)CC(C(=O)OC)NC(=O)C(C)(C)C)C(=O)OC)C(=O)OC

InChI

InChI=1S/C22H29NO9/c1-12(24)32-11-14-8-13(9-15(18(25)29-5)17(14)20(27)31-7)10-16(19(26)30-6)23-21(28)22(2,3)4/h8-9,16H,10-11H2,1-7H3,(H,23,28)