ethyl (2S)-3-(4-hydroxyphenyl)-2-[[4-(3-methylbutoxy)phenyl]carbonylamino]propanoate

Systemtic Name: ethyl (2S)-3-(4-hydroxyphenyl)-2-[[4-(3-methylbutoxy)phenyl]carbonylamino]propanoate Openeye Name: ethyl (2S)-3-(4-hydroxyphenyl)-2-[(4-isopentyloxybenzoyl)amino]propanoate CAS Name: (2S)-3-(4-hydroxyphenyl)-2-[[[4-(3-methylbutoxy)phenyl]-oxomethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl (2S)-3-(4-hydroxyphenyl)-2-[[4-(3-methylbutoxy)benzoyl]amino]propanoate Traditional Name: (2S)-3-(4-hydroxyphenyl)-2-[(4-isoamoxybenzoyl)amino]propionic acid ethyl ester Formula: C23H29NO5 MolecularWeight: 399.48006

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=C(C=C1)O)NC(=O)C2=CC=C(C=C2)OCCC(C)C

Isomeric SMILES

CCOC(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)C2=CC=C(C=C2)OCCC(C)C

InChI

InChI=1S/C23H29NO5/c1-4-28-23(27)21(15-17-5-9-19(25)10-6-17)24-22(26)18-7-11-20(12-8-18)29-14-13-16(2)3/h5-12,16,21,25H,4,13-15H2,1-3H3,(H,24,26)/t21-/m0/s1