2-[1-(4-bromanyl-2-methanoyl-phenyl)piperidin-2-yl]butanoic acid

Systemtic Name: 2-[1-(4-bromanyl-2-methanoyl-phenyl)piperidin-2-yl]butanoic acid Openeye Name: 2-[1-(4-bromo-2-formyl-phenyl)-2-piperidyl]butanoic acid CAS Name: 2-[1-(4-bromo-2-formylphenyl)-2-piperidinyl]butanoic acid IUPAC Name: 2-[1-(4-bromo-2-formylphenyl)piperidin-2-yl]butanoic acid Traditional Name: 2-[1-(4-bromo-2-formyl-phenyl)-2-piperidyl]butyric acid Formula: C16H20BrNO3 MolecularWeight: 354.2389

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1CCCCN1C2=C(C=C(C=C2)Br)C=O)C(=O)O

Isomeric SMILES

CCC(C1CCCCN1C2=C(C=C(C=C2)Br)C=O)C(=O)O

InChI

InChI=1S/C16H20BrNO3/c1-2-13(16(20)21)15-5-3-4-8-18(15)14-7-6-12(17)9-11(14)10-19/h6-7,9-10,13,15H,2-5,8H2,1H3,(H,20,21)