(2S)-2-(2-methoxyethanoylamino)-3-[4-(2-phenylethynyl)phenyl]propanoic acid

Systemtic Name: (2S)-2-(2-methoxyethanoylamino)-3-[4-(2-phenylethynyl)phenyl]propanoic acid Openeye Name: (2S)-2-[(2-methoxyacetyl)amino]-3-[4-(2-phenylethynyl)phenyl]propanoic acid CAS Name: (2S)-2-[(2-methoxy-1-oxoethyl)amino]-3-[4-(2-phenylethynyl)phenyl]propanoic acid IUPAC Name: (2S)-2-[(2-methoxyacetyl)amino]-3-[4-(2-phenylethynyl)phenyl]propanoic acid Traditional Name: (2S)-2-[(2-methoxyacetyl)amino]-3-[4-(2-phenylethynyl)phenyl]propionic acid Formula: C20H19NO4 MolecularWeight: 337.36916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)NC(CC1=CC=C(C=C1)C#CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

COCC(=O)N[C@@H](CC1=CC=C(C=C1)C#CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C20H19NO4/c1-25-14-19(22)21-18(20(23)24)13-17-11-9-16(10-12-17)8-7-15-5-3-2-4-6-15/h2-6,9-12,18H,13-14H2,1H3,(H,21,22)(H,23,24)/t18-/m0/s1