2-azanyl-3-(4-ethanoylcyclohexa-1,3-dien-5-yn-1-yl)propanoic acid

Systemtic Name: 2-azanyl-3-(4-ethanoylcyclohexa-1,3-dien-5-yn-1-yl)propanoic acid Openeye Name: 3-(4-acetylcyclohexa-1,3-dien-5-yn-1-yl)-2-amino-propanoic acid CAS Name: 3-(4-acetyl-1-cyclohexa-1,3-dien-5-ynyl)-2-aminopropanoic acid IUPAC Name: 3-(4-acetylcyclohexa-1,3-dien-5-yn-1-yl)-2-aminopropanoic acid Traditional Name: 3-(4-acetylcyclohexa-1,3-dien-5-yn-1-yl)-2-amino-propionic acid Formula: C11H11NO3 MolecularWeight: 205.20994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11NO3/c1-7(13)9-4-2-8(3-5-9)6-10(12)11(14)15/h2,4,10H,6,12H2,1H3,(H,14,15)