2-(azecan-1-yl)-5-chloranyl-benzoic acid

Systemtic Name: 2-(azecan-1-yl)-5-chloranyl-benzoic acid Openeye Name: 2-(azecan-1-yl)-5-chloro-benzoic acid CAS Name: 2-(1-azecanyl)-5-chlorobenzoic acid IUPAC Name: 2-(azecan-1-yl)-5-chlorobenzoic acid Traditional Name: 2-(azecan-1-yl)-5-chloro-benzoic acid Formula: C16H22ClNO2 MolecularWeight: 295.80438

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCN(CCCC1)C2=C(C=C(C=C2)Cl)C(=O)O

Isomeric SMILES

C1CCCCN(CCCC1)C2=C(C=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C16H22ClNO2/c17-13-8-9-15(14(12-13)16(19)20)18-10-6-4-2-1-3-5-7-11-18/h8-9,12H,1-7,10-11H2,(H,19,20)