5-azanyl-2-[4-(carboxymethyl)piperazin-1-yl]benzoic acid

Systemtic Name: 5-azanyl-2-[4-(carboxymethyl)piperazin-1-yl]benzoic acid Openeye Name: 5-amino-2-[4-(carboxymethyl)piperazin-1-yl]benzoic acid CAS Name: 5-amino-2-[4-(carboxymethyl)-1-piperazinyl]benzoic acid IUPAC Name: 5-amino-2-[4-(carboxymethyl)piperazin-1-yl]benzoic acid Traditional Name: 5-amino-2-[4-(carboxymethyl)piperazino]benzoic acid Formula: C13H17N3O4 MolecularWeight: 279.29178

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)O)C2=C(C=C(C=C2)N)C(=O)O

Isomeric SMILES

C1CN(CCN1CC(=O)O)C2=C(C=C(C=C2)N)C(=O)O

InChI

InChI=1S/C13H17N3O4/c14-9-1-2-11(10(7-9)13(19)20)16-5-3-15(4-6-16)8-12(17)18/h1-2,7H,3-6,8,14H2,(H,17,18)(H,19,20)