methyl (2S)-3-(4-aminophenyl)-2-butoxy-propanoate

Systemtic Name: methyl (2S)-3-(4-aminophenyl)-2-butoxy-propanoate Openeye Name: methyl (2S)-3-(4-aminophenyl)-2-butoxy-propanoate CAS Name: (2S)-3-(4-aminophenyl)-2-butoxypropanoic acid methyl ester IUPAC Name: methyl (2S)-3-(4-aminophenyl)-2-butoxypropanoate Traditional Name: (2S)-3-(4-aminophenyl)-2-butoxy-propionic acid methyl ester Formula: C14H21NO3 MolecularWeight: 251.32144

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(CC1=CC=C(C=C1)N)C(=O)OC

Isomeric SMILES

CCCCO[C@@H](CC1=CC=C(C=C1)N)C(=O)OC

InChI

InChI=1S/C14H21NO3/c1-3-4-9-18-13(14(16)17-2)10-11-5-7-12(15)8-6-11/h5-8,13H,3-4,9-10,15H2,1-2H3/t13-/m0/s1