(2R)-2-azanyl-3-phenyl-propanoate; chromium(3+); trihydrochloride

Systemtic Name: (2R)-2-azanyl-3-phenyl-propanoate; chromium(3+); trihydrochloride Openeye Name: chromic (2R)-2-amino-3-phenyl-propanoate trihydrochloride CAS Name: (2R)-2-amino-3-phenylpropanoate; chromium(3+); trihydrochloride IUPAC Name: (2R)-2-amino-3-phenylpropanoate; chromium(3+); trihydrochloride Traditional Name: chromic (2R)-2-amino-3-phenyl-propionate trihydrochloride Formula: C27H33Cl3CrN3O6 MolecularWeight: 653.92252

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)[O-])N.C1=CC=C(C=C1)CC(C(=O)[O-])N.C1=CC=C(C=C1)CC(C(=O)[O-])N.Cl.Cl.Cl.[Cr+3]

Isomeric SMILES

C1=CC=C(C=C1)C[C@H](C(=O)[O-])N.C1=CC=C(C=C1)C[C@H](C(=O)[O-])N.C1=CC=C(C=C1)C[C@H](C(=O)[O-])N.Cl.Cl.Cl.[Cr+3]

InChI

InChI=1S/3C9H11NO2.3ClH.Cr/c3*10-8(9(11)12)6-7-4-2-1-3-5-7;;;;/h3*1-5,8H,6,10H2,(H,11,12);3*1H;/q;;;;;;+3/p-3/t3*8-;;;;/m111..../s1