2-[4-(6-azanyl-1-oxidanyl-hexyl)phenyl]ethanoic acid

Systemtic Name: 2-[4-(6-azanyl-1-oxidanyl-hexyl)phenyl]ethanoic acid Openeye Name: 2-[4-(6-amino-1-hydroxy-hexyl)phenyl]acetic acid CAS Name: 2-[4-(6-amino-1-hydroxyhexyl)phenyl]acetic acid IUPAC Name: 2-[4-(6-amino-1-hydroxyhexyl)phenyl]acetic acid Traditional Name: 2-[4-(6-amino-1-hydroxy-hexyl)phenyl]acetic acid Formula: C14H21NO3 MolecularWeight: 251.32144

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)O)C(CCCCCN)O

Isomeric SMILES

C1=CC(=CC=C1CC(=O)O)C(CCCCCN)O

InChI

InChI=1S/C14H21NO3/c15-9-3-1-2-4-13(16)12-7-5-11(6-8-12)10-14(17)18/h5-8,13,16H,1-4,9-10,15H2,(H,17,18)