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

Systemtic Name: [3-[3-(cyclohexylamino)-7-methyl-imidazo[1,2-a]pyridin-2-yl]phenyl] 4-methylbenzoate Openeye Name: [3-[3-(cyclohexylamino)-7-methyl-imidazo[1,2-a]pyridin-2-yl]phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [3-[3-(cyclohexylamino)-7-methyl-2-imidazo[1,2-a]pyridinyl]phenyl] ester IUPAC Name: [3-[3-(cyclohexylamino)-7-methylimidazo[1,2-a]pyridin-2-yl]phenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [3-[3-(cyclohexylamino)-7-methyl-imidazo[1,2-a]pyridin-2-yl]phenyl] ester Formula: C28H29N3O2 MolecularWeight: 439.54876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=CC=CC(=C2)C3=C(N4C=CC(=CC4=N3)C)NC5CCCCC5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=CC=CC(=C2)C3=C(N4C=CC(=CC4=N3)C)NC5CCCCC5

InChI

InChI=1S/C28H29N3O2/c1-19-11-13-21(14-12-19)28(32)33-24-10-6-7-22(18-24)26-27(29-23-8-4-3-5-9-23)31-16-15-20(2)17-25(31)30-26/h6-7,10-18,23,29H,3-5,8-9H2,1-2H3