3-azanyl-4-(1-azanyl-2-methanoyl-cyclohexa-2,5-dien-1-yl)-4-oxidanylidene-butanoic acid

Systemtic Name: 3-azanyl-4-(1-azanyl-2-methanoyl-cyclohexa-2,5-dien-1-yl)-4-oxidanylidene-butanoic acid Openeye Name: 3-amino-4-(1-amino-2-formyl-cyclohexa-2,5-dien-1-yl)-4-oxo-butanoic acid CAS Name: 3-amino-4-(1-amino-2-formyl-1-cyclohexa-2,5-dienyl)-4-oxobutanoic acid IUPAC Name: 3-amino-4-(1-amino-2-formylcyclohexa-2,5-dien-1-yl)-4-oxobutanoic acid Traditional Name: 3-amino-4-(1-amino-2-formyl-cyclohexa-2,5-dien-1-yl)-4-keto-butyric acid Formula: C11H14N2O4 MolecularWeight: 238.23986

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(C(=C1)C=O)(C(=O)C(CC(=O)O)N)N

Isomeric SMILES

C1C=CC(C(=C1)C=O)(C(=O)C(CC(=O)O)N)N

InChI

InChI=1S/C11H14N2O4/c12-8(5-9(15)16)10(17)11(13)4-2-1-3-7(11)6-14/h2-4,6,8H,1,5,12-13H2,(H,15,16)