2-azanyl-3-(4-pyrrolidin-1-ylphenyl)propanoic acid dihydrochloride

Systemtic Name: 2-azanyl-3-(4-pyrrolidin-1-ylphenyl)propanoic acid dihydrochloride Openeye Name: 2-amino-3-(4-pyrrolidin-1-ylphenyl)propanoic acid dihydrochloride CAS Name: 2-amino-3-[4-(1-pyrrolidinyl)phenyl]propanoic acid dihydrochloride IUPAC Name: 2-amino-3-(4-pyrrolidin-1-ylphenyl)propanoic acid dihydrochloride Traditional Name: 2-amino-3-(4-pyrrolidinophenyl)propionic acid dihydrochloride Formula: C13H20Cl2N2O2 MolecularWeight: 307.2161

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=C(C=C2)CC(C(=O)O)N.Cl.Cl

Isomeric SMILES

C1CCN(C1)C2=CC=C(C=C2)CC(C(=O)O)N.Cl.Cl

InChI

InChI=1S/C13H18N2O2.2ClH/c14-12(13(16)17)9-10-3-5-11(6-4-10)15-7-1-2-8-15;;/h3-6,12H,1-2,7-9,14H2,(H,16,17);2*1H