3-(azepan-1-ylmethoxy)benzoic acid

Systemtic Name: 3-(azepan-1-ylmethoxy)benzoic acid Openeye Name: 3-(azepan-1-ylmethoxy)benzoic acid CAS Name: 3-(1-azepanylmethoxy)benzoic acid IUPAC Name: 3-(azepan-1-ylmethoxy)benzoic acid Traditional Name: 3-(azepan-1-ylmethoxy)benzoic acid Formula: C14H19NO3 MolecularWeight: 249.30556

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)COC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

C1CCCN(CC1)COC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C14H19NO3/c16-14(17)12-6-5-7-13(10-12)18-11-15-8-3-1-2-4-9-15/h5-7,10H,1-4,8-9,11H2,(H,16,17)