2-(5-bromanyl-1-benzofuran-2-yl)-2-piperidin-1-yl-propanoic acid

Systemtic Name: 2-(5-bromanyl-1-benzofuran-2-yl)-2-piperidin-1-yl-propanoic acid Openeye Name: 2-(5-bromobenzofuran-2-yl)-2-(1-piperidyl)propanoic acid CAS Name: 2-(5-bromo-2-benzofuranyl)-2-(1-piperidinyl)propanoic acid IUPAC Name: 2-(5-bromo-1-benzofuran-2-yl)-2-piperidin-1-ylpropanoic acid Traditional Name: 2-(5-bromobenzofuran-2-yl)-2-piperidino-propionic acid Formula: C16H18BrNO3 MolecularWeight: 352.22302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(O1)C=CC(=C2)Br)(C(=O)O)N3CCCCC3

Isomeric SMILES

CC(C1=CC2=C(O1)C=CC(=C2)Br)(C(=O)O)N3CCCCC3

InChI

InChI=1S/C16H18BrNO3/c1-16(15(19)20,18-7-3-2-4-8-18)14-10-11-9-12(17)5-6-13(11)21-14/h5-6,9-10H,2-4,7-8H2,1H3,(H,19,20)