3-(5-azanyl-4-oxidanylidene-cyclohexa-1,5-dien-1-yl)propanoic acid

Systemtic Name: 3-(5-azanyl-4-oxidanylidene-cyclohexa-1,5-dien-1-yl)propanoic acid Openeye Name: 3-(5-amino-4-oxo-cyclohexa-1,5-dien-1-yl)propanoic acid CAS Name: 3-(5-amino-4-oxo-1-cyclohexa-1,5-dienyl)propanoic acid IUPAC Name: 3-(5-amino-4-oxocyclohexa-1,5-dien-1-yl)propanoic acid Traditional Name: 3-(5-amino-4-keto-cyclohexa-1,5-dien-1-yl)propionic acid Formula: C9H11NO3 MolecularWeight: 181.18854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H11NO3/c10-7-5-6(1-3-8(7)11)2-4-9(12)13/h1,5H,2-4,10H2,(H,12,13)