[4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2-methoxy-phenyl] 4-methyl-3-nitro-benzoate

Systemtic Name: [4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2-methoxy-phenyl] 4-methyl-3-nitro-benzoate Openeye Name: [4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2-methoxy-phenyl] 4-methyl-3-nitro-benzoate CAS Name: 4-methyl-3-nitrobenzoic acid [4-[3-(cyclohexylamino)-2-imidazo[1,2-a]pyridinyl]-2-methoxyphenyl] ester IUPAC Name: [4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2-methoxyphenyl] 4-methyl-3-nitrobenzoate Traditional Name: 4-methyl-3-nitro-benzoic acid [4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2-methoxy-phenyl] ester Formula: C28H28N4O5 MolecularWeight: 500.54572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC2=C(C=C(C=C2)C3=C(N4C=CC=CC4=N3)NC5CCCCC5)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC2=C(C=C(C=C2)C3=C(N4C=CC=CC4=N3)NC5CCCCC5)OC)[N+](=O)[O-]

InChI

InChI=1S/C28H28N4O5/c1-18-11-12-20(16-22(18)32(34)35)28(33)37-23-14-13-19(17-24(23)36-2)26-27(29-21-8-4-3-5-9-21)31-15-7-6-10-25(31)30-26/h6-7,10-17,21,29H,3-5,8-9H2,1-2H3