3-[4,5-bis(azanyl)pentyl]benzoic acid

Systemtic Name: 3-[4,5-bis(azanyl)pentyl]benzoic acid Openeye Name: 3-(4,5-diaminopentyl)benzoic acid CAS Name: 3-(4,5-diaminopentyl)benzoic acid IUPAC Name: 3-(4,5-diaminopentyl)benzoic acid Traditional Name: 3-(4,5-diaminopentyl)benzoic acid Formula: C12H18N2O2 MolecularWeight: 222.28352

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CCCC(CN)N)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)CCCC(CN)N)C(=O)O

InChI

InChI=1S/C12H18N2O2/c13-8-11(14)6-2-4-9-3-1-5-10(7-9)12(15)16/h1,3,5,7,11H,2,4,6,8,13-14H2,(H,15,16)