(4Z)-4-(aminocarbonylhydrazinylidene)-3,6,6-trimethyl-5,7-dihydro-1-benzofuran-2-carboxylic acid

Systemtic Name: (4Z)-4-(aminocarbonylhydrazinylidene)-3,6,6-trimethyl-5,7-dihydro-1-benzofuran-2-carboxylic acid Openeye Name: (4Z)-4-(carbamoylhydrazono)-3,6,6-trimethyl-5,7-dihydrobenzofuran-2-carboxylic acid CAS Name: (4Z)-4-(carbamoylhydrazinylidene)-3,6,6-trimethyl-5,7-dihydrobenzofuran-2-carboxylic acid IUPAC Name: (4Z)-4-(carbamoylhydrazinylidene)-3,6,6-trimethyl-5,7-dihydro-1-benzofuran-2-carboxylic acid Traditional Name: (4Z)-3,6,6-trimethyl-4-semicarbazono-5,7-dihydrobenzofuran-2-carboxylic acid Formula: C13H17N3O4 MolecularWeight: 279.29178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)N)CC(C2)(C)C)C(=O)O

Isomeric SMILES

CC1=C(OC2=C1/C(=N\NC(=O)N)/CC(C2)(C)C)C(=O)O

InChI

InChI=1S/C13H17N3O4/c1-6-9-7(15-16-12(14)19)4-13(2,3)5-8(9)20-10(6)11(17)18/h4-5H2,1-3H3,(H,17,18)(H3,14,16,19)/b15-7-