3-[3-[5-(phenylmethoxycarbonylamino)thiophen-2-yl]-1,2,4-oxadiazol-5-yl]propanoic acid

Systemtic Name: 3-[3-[5-(phenylmethoxycarbonylamino)thiophen-2-yl]-1,2,4-oxadiazol-5-yl]propanoic acid Openeye Name: 3-[3-[5-(benzyloxycarbonylamino)-2-thienyl]-1,2,4-oxadiazol-5-yl]propanoic acid CAS Name: 3-[3-[5-(phenylmethoxycarbonylamino)-2-thiophenyl]-1,2,4-oxadiazol-5-yl]propanoic acid IUPAC Name: 3-[3-[5-(phenylmethoxycarbonylamino)thiophen-2-yl]-1,2,4-oxadiazol-5-yl]propanoic acid Traditional Name: 3-[3-[5-(benzyloxycarbonylamino)-2-thienyl]-1,2,4-oxadiazol-5-yl]propionic acid Formula: C17H15N3O5S MolecularWeight: 373.3831

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC2=CC=C(S2)C3=NOC(=N3)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC2=CC=C(S2)C3=NOC(=N3)CCC(=O)O

InChI

InChI=1S/C17H15N3O5S/c21-15(22)9-7-13-18-16(20-25-13)12-6-8-14(26-12)19-17(23)24-10-11-4-2-1-3-5-11/h1-6,8H,7,9-10H2,(H,19,23)(H,21,22)