ethanedioic acid; 3-methyl-5-[(E)-(1-methylpiperidin-3-ylidene)methyl]-1,2-oxazole

Systemtic Name: ethanedioic acid; 3-methyl-5-[(E)-(1-methylpiperidin-3-ylidene)methyl]-1,2-oxazole Openeye Name: 3-methyl-5-[(E)-(1-methyl-3-piperidylidene)methyl]isoxazole; oxalic acid CAS Name: 3-methyl-5-[(E)-(1-methyl-3-piperidinylidene)methyl]isoxazole; oxalic acid IUPAC Name: 3-methyl-5-[(E)-(1-methylpiperidin-3-ylidene)methyl]-1,2-oxazole; oxalic acid Traditional Name: 3-methyl-5-[(E)-(1-methyl-3-piperidylidene)methyl]isoxazole; oxalic acid Formula: C13H18N2O5 MolecularWeight: 282.29242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)C=C2CCCN(C2)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=NOC(=C1)/C=C/2\CCCN(C2)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C11H16N2O.C2H2O4/c1-9-6-11(14-12-9)7-10-4-3-5-13(2)8-10;3-1(4)2(5)6/h6-7H,3-5,8H2,1-2H3;(H,3,4)(H,5,6)/b10-7+;