3-(azocan-1-ylcarbonyl)benzoic acid

Systemtic Name: 3-(azocan-1-ylcarbonyl)benzoic acid Openeye Name: 3-(azocane-1-carbonyl)benzoic acid CAS Name: 3-[1-azocanyl(oxo)methyl]benzoic acid IUPAC Name: 3-(azocane-1-carbonyl)benzoic acid Traditional Name: 3-(azocane-1-carbonyl)benzoic acid Formula: C15H19NO3 MolecularWeight: 261.31626

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C(=O)C2=CC(=CC=C2)C(=O)O

Isomeric SMILES

C1CCCN(CCC1)C(=O)C2=CC(=CC=C2)C(=O)O

InChI

InChI=1S/C15H19NO3/c17-14(16-9-4-2-1-3-5-10-16)12-7-6-8-13(11-12)15(18)19/h6-8,11H,1-5,9-10H2,(H,18,19)