2-[4-(azepan-1-ylcarbonyl)phenoxy]ethanoic acid

Systemtic Name: 2-[4-(azepan-1-ylcarbonyl)phenoxy]ethanoic acid Openeye Name: 2-[4-(azepane-1-carbonyl)phenoxy]acetic acid CAS Name: 2-[4-[1-azepanyl(oxo)methyl]phenoxy]acetic acid IUPAC Name: 2-[4-(azepane-1-carbonyl)phenoxy]acetic acid Traditional Name: 2-[4-(azepane-1-carbonyl)phenoxy]acetic acid Formula: C15H19NO4 MolecularWeight: 277.31566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO4/c17-14(18)11-20-13-7-5-12(6-8-13)15(19)16-9-3-1-2-4-10-16/h5-8H,1-4,9-11H2,(H,17,18)