3-azanyl-2-cyclohexa-1,4-dien-1-yl-propanoic acid

Systemtic Name: 3-azanyl-2-cyclohexa-1,4-dien-1-yl-propanoic acid Openeye Name: 3-amino-2-cyclohexa-1,4-dien-1-yl-propanoic acid CAS Name: 3-amino-2-(1-cyclohexa-1,4-dienyl)propanoic acid IUPAC Name: 3-amino-2-cyclohexa-1,4-dien-1-ylpropanoic acid Traditional Name: 3-amino-2-cyclohexa-1,4-dien-1-yl-propionic acid Formula: C9H13NO2 MolecularWeight: 167.20502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H13NO2/c10-6-8(9(11)12)7-4-2-1-3-5-7/h1-2,5,8H,3-4,6,10H2,(H,11,12)