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

Systemtic Name: [4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 4-ethylbenzoate Openeye Name: [4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 4-ethylbenzoate CAS Name: 4-ethylbenzoic 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] 4-ethylbenzoate Traditional Name: 4-ethylbenzoic acid [4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] ester Formula: C28H29N3O2 MolecularWeight: 439.54876

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=C(N4C=CC=CC4=N3)NC5CCCCC5

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=C(N4C=CC=CC4=N3)NC5CCCCC5

InChI

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