3-[2-(3-azanylpropanoyloxy)-3,6-dimethyl-phenyl]-3-methyl-butanoic acid

Systemtic Name: 3-[2-(3-azanylpropanoyloxy)-3,6-dimethyl-phenyl]-3-methyl-butanoic acid Openeye Name: 3-[2-(3-aminopropanoyloxy)-3,6-dimethyl-phenyl]-3-methyl-butanoic acid CAS Name: 3-[2-(3-amino-1-oxopropoxy)-3,6-dimethylphenyl]-3-methylbutanoic acid IUPAC Name: 3-[2-(3-aminopropanoyloxy)-3,6-dimethylphenyl]-3-methylbutanoic acid Traditional Name: 3-[2-(3-aminopropanoyloxy)-3,6-dimethyl-phenyl]-3-methyl-butyric acid Formula: C16H23NO4 MolecularWeight: 293.35812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23NO4/c1-10-5-6-11(2)15(21-13(20)7-8-17)14(10)16(3,4)9-12(18)19/h5-6H,7-9,17H2,1-4H3,(H,18,19)