[4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 2-phenylbutanoate

Systemtic Name: [4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 2-phenylbutanoate Openeye Name: [4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 2-phenylbutanoate CAS Name: 2-phenylbutanoic acid [4-[3-(cyclohexylamino)-2-imidazo[1,2-a]pyridinyl]phenyl] ester IUPAC Name: [4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 2-phenylbutanoate Traditional Name: 2-phenylbutyric acid [4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] ester Formula: C29H31N3O2 MolecularWeight: 453.57534

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)OC2=CC=C(C=C2)C3=C(N4C=CC=CC4=N3)NC5CCCCC5

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)OC2=CC=C(C=C2)C3=C(N4C=CC=CC4=N3)NC5CCCCC5

InChI

InChI=1S/C29H31N3O2/c1-2-25(21-11-5-3-6-12-21)29(33)34-24-18-16-22(17-19-24)27-28(30-23-13-7-4-8-14-23)32-20-10-9-15-26(32)31-27/h3,5-6,9-12,15-20,23,25,30H,2,4,7-8,13-14H2,1H3