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

Systemtic Name: methyl (2S)-2-[4-(2-azanylethyl)phenoxy]-2-methyl-butanoate Openeye Name: methyl (2S)-2-[4-(2-aminoethyl)phenoxy]-2-methyl-butanoate CAS Name: (2S)-2-[4-(2-aminoethyl)phenoxy]-2-methylbutanoic acid methyl ester IUPAC Name: methyl (2S)-2-[4-(2-aminoethyl)phenoxy]-2-methylbutanoate Traditional Name: (2S)-2-[4-(2-aminoethyl)phenoxy]-2-methyl-butyric acid methyl ester Formula: C14H21NO3 MolecularWeight: 251.32144

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C(=O)OC)OC1=CC=C(C=C1)CCN

Isomeric SMILES

CC[C@@](C)(C(=O)OC)OC1=CC=C(C=C1)CCN

InChI

InChI=1S/C14H21NO3/c1-4-14(2,13(16)17-3)18-12-7-5-11(6-8-12)9-10-15/h5-8H,4,9-10,15H2,1-3H3/t14-/m0/s1