2-[4-[1-(azepan-2-yl)ethoxy]phenyl]ethanoic acid

Systemtic Name: 2-[4-[1-(azepan-2-yl)ethoxy]phenyl]ethanoic acid Openeye Name: 2-[4-[1-(azepan-2-yl)ethoxy]phenyl]acetic acid CAS Name: 2-[4-[1-(2-azepanyl)ethoxy]phenyl]acetic acid IUPAC Name: 2-[4-[1-(azepan-2-yl)ethoxy]phenyl]acetic acid Traditional Name: 2-[4-[1-(azepan-2-yl)ethoxy]phenyl]acetic acid Formula: C16H23NO3 MolecularWeight: 277.35872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCCCN1)OC2=CC=C(C=C2)CC(=O)O

Isomeric SMILES

CC(C1CCCCCN1)OC2=CC=C(C=C2)CC(=O)O

InChI

InChI=1S/C16H23NO3/c1-12(15-5-3-2-4-10-17-15)20-14-8-6-13(7-9-14)11-16(18)19/h6-9,12,15,17H,2-5,10-11H2,1H3,(H,18,19)