2-azanyl-2-(4-isothiocyanatophenyl)propanoic acid

Systemtic Name: 2-azanyl-2-(4-isothiocyanatophenyl)propanoic acid Openeye Name: 2-amino-2-(4-isothiocyanatophenyl)propanoic acid CAS Name: 2-amino-2-(4-isothiocyanatophenyl)propanoic acid IUPAC Name: 2-amino-2-(4-isothiocyanatophenyl)propanoic acid Traditional Name: 2-amino-2-(4-isothiocyanatophenyl)propionic acid Formula: C10H10N2O2S MolecularWeight: 222.2636

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10N2O2S/c1-10(11,9(13)14)7-2-4-8(5-3-7)12-6-15/h2-5H,11H2,1H3,(H,13,14)