2-(azepan-1-yl)-6-chloranyl-benzoate

Systemtic Name: 2-(azepan-1-yl)-6-chloranyl-benzoate Openeye Name: 2-(azepan-1-yl)-6-chloro-benzoate CAS Name: 2-(1-azepanyl)-6-chlorobenzoate IUPAC Name: 2-(azepan-1-yl)-6-chlorobenzoate Traditional Name: 2-(azepan-1-yl)-6-chloro-benzoate Formula: C13H15ClNO2- MolecularWeight: 252.7167

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C(=CC=C2)Cl)C(=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C2=C(C(=CC=C2)Cl)C(=O)[O-]

InChI

InChI=1S/C13H16ClNO2/c14-10-6-5-7-11(12(10)13(16)17)15-8-3-1-2-4-9-15/h5-7H,1-4,8-9H2,(H,16,17)/p-1