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

Systemtic Name: 2-[4-(azepan-1-yl)phenyl]ethanoic acid Openeye Name: 2-[4-(azepan-1-yl)phenyl]acetic acid CAS Name: 2-[4-(1-azepanyl)phenyl]acetic acid IUPAC Name: 2-[4-(azepan-1-yl)phenyl]acetic acid Traditional Name: 2-[4-(azepan-1-yl)phenyl]acetic acid Formula: C14H19NO2 MolecularWeight: 233.30616

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO2/c16-14(17)11-12-5-7-13(8-6-12)15-9-3-1-2-4-10-15/h5-8H,1-4,9-11H2,(H,16,17)