ethanedioic acid; N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]butan-2-amine

Systemtic Name: ethanedioic acid; N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]butan-2-amine Openeye Name: oxalic acid; N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]butan-2-amine CAS Name: oxalic acid; N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-2-butanamine IUPAC Name: oxalic acid; N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]butan-2-amine Traditional Name: oxalic acid; (5-phenyl-1,3,4-oxadiazol-2-yl)methyl-sec-butyl-amine Formula: C15H19N3O5 MolecularWeight: 321.32846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NCC1=NN=C(O1)C2=CC=CC=C2.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(C)NCC1=NN=C(O1)C2=CC=CC=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H17N3O.C2H2O4/c1-3-10(2)14-9-12-15-16-13(17-12)11-7-5-4-6-8-11;3-1(4)2(5)6/h4-8,10,14H,3,9H2,1-2H3;(H,3,4)(H,5,6)