3-[3-[(2-aminocarbonylhydrazinyl)methylidene]-5-methoxy-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]propanoic acid

Systemtic Name: 3-[3-[(2-aminocarbonylhydrazinyl)methylidene]-5-methoxy-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]propanoic acid Openeye Name: 3-[3-[(2-carbamoylhydrazino)methylene]-5-methoxy-4-oxo-cyclohexa-1,5-dien-1-yl]propanoic acid CAS Name: 3-[3-[(carbamoylhydrazo)methylidene]-5-methoxy-4-oxo-1-cyclohexa-1,5-dienyl]propanoic acid IUPAC Name: 3-[3-[(2-carbamoylhydrazinyl)methylidene]-5-methoxy-4-oxocyclohexa-1,5-dien-1-yl]propanoic acid Traditional Name: 3-[4-keto-5-methoxy-3-(semicarbazidomethylene)cyclohexa-1,5-dien-1-yl]propionic acid Formula: C12H15N3O5 MolecularWeight: 281.2646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=CNNC(=O)N)C1=O)CCC(=O)O

Isomeric SMILES

COC1=CC(=CC(=CNNC(=O)N)C1=O)CCC(=O)O

InChI

InChI=1S/C12H15N3O5/c1-20-9-5-7(2-3-10(16)17)4-8(11(9)18)6-14-15-12(13)19/h4-6,14H,2-3H2,1H3,(H,16,17)(H3,13,15,19)