3-[2-[1-(4-bromophenyl)carbonyl-3,6-dihydro-2H-pyridin-4-yl]phenoxy]propanoic acid

Systemtic Name: 3-[2-[1-(4-bromophenyl)carbonyl-3,6-dihydro-2H-pyridin-4-yl]phenoxy]propanoic acid Openeye Name: 3-[2-[1-(4-bromobenzoyl)-3,6-dihydro-2H-pyridin-4-yl]phenoxy]propanoic acid CAS Name: 3-[2-[1-[(4-bromophenyl)-oxomethyl]-3,6-dihydro-2H-pyridin-4-yl]phenoxy]propanoic acid IUPAC Name: 3-[2-[1-(4-bromobenzoyl)-3,6-dihydro-2H-pyridin-4-yl]phenoxy]propanoic acid Traditional Name: 3-[2-[1-(4-bromobenzoyl)-3,6-dihydro-2H-pyridin-4-yl]phenoxy]propionic acid Formula: C21H20BrNO4 MolecularWeight: 430.2918

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC=C1C2=CC=CC=C2OCCC(=O)O)C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CN(CC=C1C2=CC=CC=C2OCCC(=O)O)C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H20BrNO4/c22-17-7-5-16(6-8-17)21(26)23-12-9-15(10-13-23)18-3-1-2-4-19(18)27-14-11-20(24)25/h1-9H,10-14H2,(H,24,25)