(3S)-3-(4-ethoxy-3-methoxy-phenyl)-3-[2-(2-methoxyphenoxy)ethanoylamino]propanoic acid

Systemtic Name: (3S)-3-(4-ethoxy-3-methoxy-phenyl)-3-[2-(2-methoxyphenoxy)ethanoylamino]propanoic acid Openeye Name: (3S)-3-(4-ethoxy-3-methoxy-phenyl)-3-[[2-(2-methoxyphenoxy)acetyl]amino]propanoic acid CAS Name: (3S)-3-(4-ethoxy-3-methoxyphenyl)-3-[[2-(2-methoxyphenoxy)-1-oxoethyl]amino]propanoic acid IUPAC Name: (3S)-3-(4-ethoxy-3-methoxyphenyl)-3-[[2-(2-methoxyphenoxy)acetyl]amino]propanoic acid Traditional Name: (3S)-3-(4-ethoxy-3-methoxy-phenyl)-3-[[2-(2-methoxyphenoxy)acetyl]amino]propionic acid Formula: C21H25NO7 MolecularWeight: 403.4257

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(CC(=O)O)NC(=O)COC2=CC=CC=C2OC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)[C@H](CC(=O)O)NC(=O)COC2=CC=CC=C2OC)OC

InChI

InChI=1S/C21H25NO7/c1-4-28-18-10-9-14(11-19(18)27-3)15(12-21(24)25)22-20(23)13-29-17-8-6-5-7-16(17)26-2/h5-11,15H,4,12-13H2,1-3H3,(H,22,23)(H,24,25)/t15-/m0/s1