3-[2-[2-(2-azanylethoxy)ethoxycarbonyloxy]-4,6-dimethyl-phenyl]-3-methyl-butanoic acid

Systemtic Name: 3-[2-[2-(2-azanylethoxy)ethoxycarbonyloxy]-4,6-dimethyl-phenyl]-3-methyl-butanoic acid Openeye Name: 3-[2-[2-(2-aminoethoxy)ethoxycarbonyloxy]-4,6-dimethyl-phenyl]-3-methyl-butanoic acid CAS Name: 3-[2-[2-(2-aminoethoxy)ethoxy-oxomethoxy]-4,6-dimethylphenyl]-3-methylbutanoic acid IUPAC Name: 3-[2-[2-(2-aminoethoxy)ethoxycarbonyloxy]-4,6-dimethylphenyl]-3-methylbutanoic acid Traditional Name: 3-[2-[2-(2-aminoethoxy)ethoxycarbonyloxy]-4,6-dimethyl-phenyl]-3-methyl-butyric acid Formula: C18H27NO6 MolecularWeight: 353.41008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OC(=O)OCCOCCN)C(C)(C)CC(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OC(=O)OCCOCCN)C(C)(C)CC(=O)O)C

InChI

InChI=1S/C18H27NO6/c1-12-9-13(2)16(18(3,4)11-15(20)21)14(10-12)25-17(22)24-8-7-23-6-5-19/h9-10H,5-8,11,19H2,1-4H3,(H,20,21)