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

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

Systemtic Name:4-azanyl-2-[3-(5-azanyl-2-carboxy-phenyl)propyl]benzoic acid
Openeye Name:4-amino-2-[3-(5-amino-2-carboxy-phenyl)propyl]benzoic acid
CAS Name:4-amino-2-[3-(5-amino-2-carboxyphenyl)propyl]benzoic acid
IUPAC Name:4-amino-2-[3-(5-amino-2-carboxyphenyl)propyl]benzoic acid
Traditional Name:4-amino-2-[3-(5-amino-2-carboxy-phenyl)propyl]benzoic acid
Formula: C17H18N2O4
MolecularWeight: 314.33582
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)CCCC2=C(C=CC(=C2)N)C(=O)O)C(=O)O


Isomeric SMILES

C1=CC(=C(C=C1N)CCCC2=C(C=CC(=C2)N)C(=O)O)C(=O)O


InChI

InChI=1S/C17H18N2O4/c18-12-4-6-14(16(20)21)10(8-12)2-1-3-11-9-13(19)5-7-15(11)17(22)23/h4-9H,1-3,18-19H2,(H,20,21)(H,22,23)


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