3-azanyl-3-pyridin-3-yl-propanoate; 2,3-bis(oxidanyl)butanedioate

Systemtic Name: 3-azanyl-3-pyridin-3-yl-propanoate; 2,3-bis(oxidanyl)butanedioate Openeye Name: 3-amino-3-(3-pyridyl)propanoate; 2,3-dihydroxybutanedioate CAS Name: 3-amino-3-(3-pyridinyl)propanoate; 2,3-dihydroxybutanedioate IUPAC Name: 3-amino-3-pyridin-3-ylpropanoate; 2,3-dihydroxybutanedioate Traditional Name: 3-amino-3-(3-pyridyl)propionate tartrate Formula: C12H13N2O8-3 MolecularWeight: 313.24022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(CC(=O)[O-])N.C(C(C(=O)[O-])O)(C(=O)[O-])O

Isomeric SMILES

C1=CC(=CN=C1)C(CC(=O)[O-])N.C(C(C(=O)[O-])O)(C(=O)[O-])O

InChI

InChI=1S/C8H10N2O2.C4H6O6/c9-7(4-8(11)12)6-2-1-3-10-5-6;5-1(3(7)8)2(6)4(9)10/h1-3,5,7H,4,9H2,(H,11,12);1-2,5-6H,(H,7,8)(H,9,10)/p-3