methyl 2-(azepan-1-ylcarbonyl)benzoate

Systemtic Name: methyl 2-(azepan-1-ylcarbonyl)benzoate Openeye Name: methyl 2-(azepane-1-carbonyl)benzoate CAS Name: 2-[1-azepanyl(oxo)methyl]benzoic acid methyl ester IUPAC Name: methyl 2-(azepane-1-carbonyl)benzoate Traditional Name: 2-(azepane-1-carbonyl)benzoic acid methyl ester Formula: C15H19NO3 MolecularWeight: 261.31626

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C(=O)N2CCCCCC2

Isomeric SMILES

COC(=O)C1=CC=CC=C1C(=O)N2CCCCCC2

InChI

InChI=1S/C15H19NO3/c1-19-15(18)13-9-5-4-8-12(13)14(17)16-10-6-2-3-7-11-16/h4-5,8-9H,2-3,6-7,10-11H2,1H3