2-azanyl-3-(1-azanylhexyl)benzoic acid

Systemtic Name: 2-azanyl-3-(1-azanylhexyl)benzoic acid Openeye Name: 2-amino-3-(1-aminohexyl)benzoic acid CAS Name: 2-amino-3-(1-aminohexyl)benzoic acid IUPAC Name: 2-amino-3-(1-aminohexyl)benzoic acid Traditional Name: 2-amino-3-(1-aminohexyl)benzoic acid Formula: C13H20N2O2 MolecularWeight: 236.3101

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=CC=CC(=C1N)C(=O)O)N

Isomeric SMILES

CCCCCC(C1=CC=CC(=C1N)C(=O)O)N

InChI

InChI=1S/C13H20N2O2/c1-2-3-4-8-11(14)9-6-5-7-10(12(9)15)13(16)17/h5-7,11H,2-4,8,14-15H2,1H3,(H,16,17)