[2-[3-(cyclohexylamino)-7-methyl-imidazo[1,2-a]pyridin-2-yl]phenyl] 4-pentylbenzoate

Systemtic Name: [2-[3-(cyclohexylamino)-7-methyl-imidazo[1,2-a]pyridin-2-yl]phenyl] 4-pentylbenzoate Openeye Name: [2-[3-(cyclohexylamino)-7-methyl-imidazo[1,2-a]pyridin-2-yl]phenyl] 4-pentylbenzoate CAS Name: 4-pentylbenzoic acid [2-[3-(cyclohexylamino)-7-methyl-2-imidazo[1,2-a]pyridinyl]phenyl] ester IUPAC Name: [2-[3-(cyclohexylamino)-7-methylimidazo[1,2-a]pyridin-2-yl]phenyl] 4-pentylbenzoate Traditional Name: 4-amylbenzoic acid [2-[3-(cyclohexylamino)-7-methyl-imidazo[1,2-a]pyridin-2-yl]phenyl] ester Formula: C32H37N3O2 MolecularWeight: 495.65508

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2C3=C(N4C=CC(=CC4=N3)C)NC5CCCCC5

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2C3=C(N4C=CC(=CC4=N3)C)NC5CCCCC5

InChI

InChI=1S/C32H37N3O2/c1-3-4-6-11-24-16-18-25(19-17-24)32(36)37-28-15-10-9-14-27(28)30-31(33-26-12-7-5-8-13-26)35-21-20-23(2)22-29(35)34-30/h9-10,14-22,26,33H,3-8,11-13H2,1-2H3