2-azanylethanoic acid; 2-azanyl-3-phenyl-propanoic acid; 2-azanyl-3-sulfanyl-propanoic acid

Systemtic Name: 2-azanylethanoic acid; 2-azanyl-3-phenyl-propanoic acid; 2-azanyl-3-sulfanyl-propanoic acid Openeye Name: 2-aminoacetic acid; 2-amino-3-phenyl-propanoic acid; 2-amino-3-sulfanyl-propanoic acid CAS Name: 2-aminoacetic acid; 2-amino-3-mercaptopropanoic acid; 2-amino-3-phenylpropanoic acid IUPAC Name: 2-aminoacetic acid; 2-amino-3-phenylpropanoic acid; 2-amino-3-sulfanylpropanoic acid Traditional Name: 2-aminoacetic acid; 2-amino-3-mercapto-propionic acid; 2-amino-3-phenyl-propionic acid Formula: C14H23N3O6S MolecularWeight: 361.41392

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)N.C(C(C(=O)O)N)S.C(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)N.C(C(C(=O)O)N)S.C(C(=O)O)N

InChI

InChI=1S/C9H11NO2.C3H7NO2S.C2H5NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7;4-2(1-7)3(5)6;3-1-2(4)5/h1-5,8H,6,10H2,(H,11,12);2,7H,1,4H2,(H,5,6);1,3H2,(H,4,5)