[3-[6-bromanyl-3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 3-methoxybenzoate

Systemtic Name: [3-[6-bromanyl-3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 3-methoxybenzoate Openeye Name: [3-[6-bromo-3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 3-methoxybenzoate CAS Name: 3-methoxybenzoic acid [3-[6-bromo-3-(cyclohexylamino)-2-imidazo[1,2-a]pyridinyl]phenyl] ester IUPAC Name: [3-[6-bromo-3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 3-methoxybenzoate Traditional Name: 3-methoxybenzoic acid [3-[6-bromo-3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] ester Formula: C27H26BrN3O3 MolecularWeight: 520.41764

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)OC2=CC=CC(=C2)C3=C(N4C=C(C=CC4=N3)Br)NC5CCCCC5

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)OC2=CC=CC(=C2)C3=C(N4C=C(C=CC4=N3)Br)NC5CCCCC5

InChI

InChI=1S/C27H26BrN3O3/c1-33-22-11-6-8-19(16-22)27(32)34-23-12-5-7-18(15-23)25-26(29-21-9-3-2-4-10-21)31-17-20(28)13-14-24(31)30-25/h5-8,11-17,21,29H,2-4,9-10H2,1H3