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

Systemtic Name: 3-[3-[5-(dimethylaminomethyl)-1-methyl-pyrrol-2-yl]-1,2,4-oxadiazol-5-yl]propanoic acid Openeye Name: 3-[3-[5-(dimethylaminomethyl)-1-methyl-pyrrol-2-yl]-1,2,4-oxadiazol-5-yl]propanoic acid CAS Name: 3-[3-[5-(dimethylaminomethyl)-1-methyl-2-pyrrolyl]-1,2,4-oxadiazol-5-yl]propanoic acid IUPAC Name: 3-[3-[5-(dimethylaminomethyl)-1-methylpyrrol-2-yl]-1,2,4-oxadiazol-5-yl]propanoic acid Traditional Name: 3-[3-[5-(dimethylaminomethyl)-1-methyl-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:

CN1C(=CC=C1C2=NOC(=N2)CCC(=O)O)CN(C)C

Isomeric SMILES

CN1C(=CC=C1C2=NOC(=N2)CCC(=O)O)CN(C)C

InChI

InChI=1S/C13H18N4O3/c1-16(2)8-9-4-5-10(17(9)3)13-14-11(20-15-13)6-7-12(18)19/h4-5H,6-8H2,1-3H3,(H,18,19)