methyl 2-[4-(2-azanylethyl)phenoxy]-2-methyl-butanoate ethanoate

Systemtic Name: methyl 2-[4-(2-azanylethyl)phenoxy]-2-methyl-butanoate ethanoate Openeye Name: methyl 2-[4-(2-aminoethyl)phenoxy]-2-methyl-butanoate acetate CAS Name: 2-[4-(2-aminoethyl)phenoxy]-2-methylbutanoic acid methyl ester acetate IUPAC Name: methyl 2-[4-(2-aminoethyl)phenoxy]-2-methylbutanoate acetate Traditional Name: 2-[4-(2-aminoethyl)phenoxy]-2-methyl-butyric acid methyl ester acetate Formula: C16H24NO5- MolecularWeight: 310.36546

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C(=O)OC)OC1=CC=C(C=C1)CCN.CC(=O)[O-]

Isomeric SMILES

CCC(C)(C(=O)OC)OC1=CC=C(C=C1)CCN.CC(=O)[O-]

InChI

InChI=1S/C14H21NO3.C2H4O2/c1-4-14(2,13(16)17-3)18-12-7-5-11(6-8-12)9-10-15;1-2(3)4/h5-8H,4,9-10,15H2,1-3H3;1H3,(H,3,4)/p-1