2-(azocan-1-yl)-4-bromanyl-benzoic acid

Systemtic Name: 2-(azocan-1-yl)-4-bromanyl-benzoic acid Openeye Name: 2-(azocan-1-yl)-4-bromo-benzoic acid CAS Name: 2-(1-azocanyl)-4-bromobenzoic acid IUPAC Name: 2-(azocan-1-yl)-4-bromobenzoic acid Traditional Name: 2-(azocan-1-yl)-4-bromo-benzoic acid Formula: C14H18BrNO2 MolecularWeight: 312.20222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18BrNO2/c15-11-6-7-12(14(17)18)13(10-11)16-8-4-2-1-3-5-9-16/h6-7,10H,1-5,8-9H2,(H,17,18)