2-azanyl-3-sulfanyl-propanoic acid; 5-chloranyl-2-oxidanyl-benzaldehyde

Systemtic Name: 2-azanyl-3-sulfanyl-propanoic acid; 5-chloranyl-2-oxidanyl-benzaldehyde Openeye Name: 2-amino-3-sulfanyl-propanoic acid; 5-chloro-2-hydroxy-benzaldehyde CAS Name: 2-amino-3-mercaptopropanoic acid; 5-chloro-2-hydroxybenzaldehyde IUPAC Name: 2-amino-3-sulfanylpropanoic acid; 5-chloro-2-hydroxybenzaldehyde Traditional Name: 2-amino-3-mercapto-propionic acid; 5-chloro-2-hydroxy-benzaldehyde Formula: C10H12ClNO4S MolecularWeight: 277.72458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)C=O)O.C(C(C(=O)O)N)S

Isomeric SMILES

C1=CC(=C(C=C1Cl)C=O)O.C(C(C(=O)O)N)S

InChI

InChI=1S/C7H5ClO2.C3H7NO2S/c8-6-1-2-7(10)5(3-6)4-9;4-2(1-7)3(5)6/h1-4,10H;2,7H,1,4H2,(H,5,6)