3-azanyl-2-(quinolin-8-ylsulfonylamino)propanoate dihydrochloride

Systemtic Name: 3-azanyl-2-(quinolin-8-ylsulfonylamino)propanoate dihydrochloride Openeye Name: 3-amino-2-(8-quinolylsulfonylamino)propanoate dihydrochloride CAS Name: 3-amino-2-(8-quinolinylsulfonylamino)propanoate dihydrochloride IUPAC Name: 3-amino-2-(quinolin-8-ylsulfonylamino)propanoate dihydrochloride Traditional Name: 3-amino-2-(8-quinolylsulfonylamino)propionate dihydrochloride Formula: C12H14Cl2N3O4S- MolecularWeight: 367.22826

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)S(=O)(=O)NC(CN)C(=O)[O-])N=CC=C2.Cl.Cl

Isomeric SMILES

C1=CC2=C(C(=C1)S(=O)(=O)NC(CN)C(=O)[O-])N=CC=C2.Cl.Cl

InChI

InChI=1S/C12H13N3O4S.2ClH/c13-7-9(12(16)17)15-20(18,19)10-5-1-3-8-4-2-6-14-11(8)10;;/h1-6,9,15H,7,13H2,(H,16,17);2*1H/p-1