3-[3-[1-(2-dimethylaminoethyl)pyrrol-2-yl]-1,2,4-oxadiazol-5-yl]propanoic acid

Systemtic Name: 3-[3-[1-(2-dimethylaminoethyl)pyrrol-2-yl]-1,2,4-oxadiazol-5-yl]propanoic acid Openeye Name: 3-[3-[1-(2-dimethylaminoethyl)pyrrol-2-yl]-1,2,4-oxadiazol-5-yl]propanoic acid CAS Name: 3-[3-[1-(2-dimethylaminoethyl)-2-pyrrolyl]-1,2,4-oxadiazol-5-yl]propanoic acid IUPAC Name: 3-[3-[1-(2-dimethylaminoethyl)pyrrol-2-yl]-1,2,4-oxadiazol-5-yl]propanoic acid Traditional Name: 3-[3-[1-(2-dimethylaminoethyl)pyrrol-2-yl]-1,2,4-oxadiazol-5-yl]propionic acid Formula: C13H18N4O3 MolecularWeight: 278.30702

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1C=CC=C1C2=NOC(=N2)CCC(=O)O

Isomeric SMILES

CN(C)CCN1C=CC=C1C2=NOC(=N2)CCC(=O)O

InChI

InChI=1S/C13H18N4O3/c1-16(2)8-9-17-7-3-4-10(17)13-14-11(20-15-13)5-6-12(18)19/h3-4,7H,5-6,8-9H2,1-2H3,(H,18,19)