2-acetamido-3-pyridin-3-yl-propanoic acid; bicyclo[3.1.0]hexa-1(6),2,4-triene

Systemtic Name: 2-acetamido-3-pyridin-3-yl-propanoic acid; bicyclo[3.1.0]hexa-1(6),2,4-triene Openeye Name: 2-acetamido-3-(3-pyridyl)propanoic acid; bicyclo[3.1.0]hexa-1(6),2,4-triene CAS Name: 2-acetamido-3-(3-pyridinyl)propanoic acid; bicyclo[3.1.0]hexa-1(6),2,4-triene IUPAC Name: 2-acetamido-3-pyridin-3-ylpropanoic acid; bicyclo[3.1.0]hexa-1(6),2,4-triene Traditional Name: 2-acetamido-3-(3-pyridyl)propionic acid; bicyclo[3.1.0]hexa-1(6),2,4-triene Formula: C16H16N2O3 MolecularWeight: 284.30984

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CN=CC=C1)C(=O)O.C1=CC2=CC2=C1

Isomeric SMILES

CC(=O)NC(CC1=CN=CC=C1)C(=O)O.C1=CC2=CC2=C1

InChI

InChI=1S/C10H12N2O3.C6H4/c1-7(13)12-9(10(14)15)5-8-3-2-4-11-6-8;1-2-5-4-6(5)3-1/h2-4,6,9H,5H2,1H3,(H,12,13)(H,14,15);1-4H