2-[(6-azanyl-2-chloranyl-3-pyrrolidin-1-yl-phenyl)methylamino]ethanoate

Systemtic Name: 2-[(6-azanyl-2-chloranyl-3-pyrrolidin-1-yl-phenyl)methylamino]ethanoate Openeye Name: 2-[(6-amino-2-chloro-3-pyrrolidin-1-yl-phenyl)methylamino]acetate CAS Name: 2-[[6-amino-2-chloro-3-(1-pyrrolidinyl)phenyl]methylamino]acetate IUPAC Name: 2-[(6-amino-2-chloro-3-pyrrolidin-1-ylphenyl)methylamino]acetate Traditional Name: 2-[(6-amino-2-chloro-3-pyrrolidino-benzyl)amino]acetate Formula: C13H17ClN3O2- MolecularWeight: 282.74598

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C(=C(C=C2)N)CNCC(=O)[O-])Cl

Isomeric SMILES

C1CCN(C1)C2=C(C(=C(C=C2)N)CNCC(=O)[O-])Cl

InChI

InChI=1S/C13H18ClN3O2/c14-13-9(7-16-8-12(18)19)10(15)3-4-11(13)17-5-1-2-6-17/h3-4,16H,1-2,5-8,15H2,(H,18,19)/p-1