2-azanylpropanoic acid; 5-methyl-7-thiabicyclo[4.2.0]octa-1,3,5-triene

Systemtic Name: 2-azanylpropanoic acid; 5-methyl-7-thiabicyclo[4.2.0]octa-1,3,5-triene Openeye Name: 2-aminopropanoic acid; 5-methyl-7-thiabicyclo[4.2.0]octa-1,3,5-triene CAS Name: 2-aminopropanoic acid; 5-methyl-7-thiabicyclo[4.2.0]octa-1,3,5-triene IUPAC Name: 2-aminopropanoic acid; 5-methyl-7-thiabicyclo[4.2.0]octa-1,3,5-triene Traditional Name: 2-aminopropionic acid; 5-methyl-7-thiabicyclo[4.2.0]octa-1,3,5-triene Formula: C11H15NO2S MolecularWeight: 225.3073

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1SC2.CC(C(=O)O)N

Isomeric SMILES

CC1=CC=CC2=C1SC2.CC(C(=O)O)N

InChI

InChI=1S/C8H8S.C3H7NO2/c1-6-3-2-4-7-5-9-8(6)7;1-2(4)3(5)6/h2-4H,5H2,1H3;2H,4H2,1H3,(H,5,6)