2-azanyl-5-[(4-azanyl-3-carboxy-phenyl)methyl]benzoic acid dihydrochloride

Systemtic Name: 2-azanyl-5-[(4-azanyl-3-carboxy-phenyl)methyl]benzoic acid dihydrochloride Openeye Name: 2-amino-5-[(4-amino-3-carboxy-phenyl)methyl]benzoic acid dihydrochloride CAS Name: 2-amino-5-[(4-amino-3-carboxyphenyl)methyl]benzoic acid dihydrochloride IUPAC Name: 2-amino-5-[(4-amino-3-carboxyphenyl)methyl]benzoic acid dihydrochloride Traditional Name: 2-amino-5-(4-amino-3-carboxy-benzyl)benzoic acid dihydrochloride Formula: C15H16Cl2N2O4 MolecularWeight: 359.20454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CC2=CC(=C(C=C2)N)C(=O)O)C(=O)O)N.Cl.Cl

Isomeric SMILES

C1=CC(=C(C=C1CC2=CC(=C(C=C2)N)C(=O)O)C(=O)O)N.Cl.Cl

InChI

InChI=1S/C15H14N2O4.2ClH/c16-12-3-1-8(6-10(12)14(18)19)5-9-2-4-13(17)11(7-9)15(20)21;;/h1-4,6-7H,5,16-17H2,(H,18,19)(H,20,21);2*1H