1-[1-(5-bromanyl-2-methoxy-phenyl)ethyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[1-(5-bromanyl-2-methoxy-phenyl)ethyl]piperidine-3-carboxylic acid Openeye Name: 1-[1-(5-bromo-2-methoxy-phenyl)ethyl]piperidine-3-carboxylic acid CAS Name: 1-[1-(5-bromo-2-methoxyphenyl)ethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[1-(5-bromo-2-methoxyphenyl)ethyl]piperidine-3-carboxylic acid Traditional Name: 1-[1-(5-bromo-2-methoxy-phenyl)ethyl]nipecotic acid Formula: C15H20BrNO3 MolecularWeight: 342.2282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC(=C1)Br)OC)N2CCCC(C2)C(=O)O

Isomeric SMILES

CC(C1=C(C=CC(=C1)Br)OC)N2CCCC(C2)C(=O)O

InChI

InChI=1S/C15H20BrNO3/c1-10(13-8-12(16)5-6-14(13)20-2)17-7-3-4-11(9-17)15(18)19/h5-6,8,10-11H,3-4,7,9H2,1-2H3,(H,18,19)