5-bromanyl-2-methoxy-4-[2-[1-(2-methyl-6-piperidin-1-yl-phenyl)ethylamino]-2-oxidanylidene-ethyl]benzoic acid

Systemtic Name: 5-bromanyl-2-methoxy-4-[2-[1-(2-methyl-6-piperidin-1-yl-phenyl)ethylamino]-2-oxidanylidene-ethyl]benzoic acid Openeye Name: 5-bromo-2-methoxy-4-[2-[1-[2-methyl-6-(1-piperidyl)phenyl]ethylamino]-2-oxo-ethyl]benzoic acid CAS Name: 5-bromo-2-methoxy-4-[2-[1-[2-methyl-6-(1-piperidinyl)phenyl]ethylamino]-2-oxoethyl]benzoic acid IUPAC Name: 5-bromo-2-methoxy-4-[2-[1-(2-methyl-6-piperidin-1-ylphenyl)ethylamino]-2-oxoethyl]benzoic acid Traditional Name: 5-bromo-4-[2-keto-2-[1-(2-methyl-6-piperidino-phenyl)ethylamino]ethyl]-2-methoxy-benzoic acid Formula: C24H29BrN2O4 MolecularWeight: 489.40206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCCCC2)C(C)NC(=O)CC3=C(C=C(C(=C3)OC)C(=O)O)Br

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCCCC2)C(C)NC(=O)CC3=C(C=C(C(=C3)OC)C(=O)O)Br

InChI

InChI=1S/C24H29BrN2O4/c1-15-8-7-9-20(27-10-5-4-6-11-27)23(15)16(2)26-22(28)13-17-12-21(31-3)18(24(29)30)14-19(17)25/h7-9,12,14,16H,4-6,10-11,13H2,1-3H3,(H,26,28)(H,29,30)