[4-[4-(4-propylcyclohexyl)phenyl]phenyl] 5-bromanylpyridine-3-carboxylate

Systemtic Name: [4-[4-(4-propylcyclohexyl)phenyl]phenyl] 5-bromanylpyridine-3-carboxylate Openeye Name: [4-[4-(4-propylcyclohexyl)phenyl]phenyl] 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid [4-[4-(4-propylcyclohexyl)phenyl]phenyl] ester IUPAC Name: [4-[4-(4-propylcyclohexyl)phenyl]phenyl] 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid [4-[4-(4-propylcyclohexyl)phenyl]phenyl] ester Formula: C27H28BrNO2 MolecularWeight: 478.42072

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(=O)C4=CC(=CN=C4)Br

Isomeric SMILES

CCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(=O)C4=CC(=CN=C4)Br

InChI

InChI=1S/C27H28BrNO2/c1-2-3-19-4-6-20(7-5-19)21-8-10-22(11-9-21)23-12-14-26(15-13-23)31-27(30)24-16-25(28)18-29-17-24/h8-20H,2-7H2,1H3