4-(azepan-1-ylcarbonyl)benzoic acid

Systemtic Name: 4-(azepan-1-ylcarbonyl)benzoic acid Openeye Name: 4-(azepane-1-carbonyl)benzoic acid CAS Name: 4-[1-azepanyl(oxo)methyl]benzoic acid IUPAC Name: 4-(azepane-1-carbonyl)benzoic acid Traditional Name: 4-(azepane-1-carbonyl)benzoic acid Formula: C14H17NO3 MolecularWeight: 247.28968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO3/c16-13(15-9-3-1-2-4-10-15)11-5-7-12(8-6-11)14(17)18/h5-8H,1-4,9-10H2,(H,17,18)