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

Systemtic Name: [4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2-methoxy-phenyl] adamantane-1-carboxylate Openeye Name: [4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2-methoxy-phenyl] adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic 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] adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid [4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2-methoxy-phenyl] ester Formula: C31H37N3O3 MolecularWeight: 499.64378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=C(N3C=CC=CC3=N2)NC4CCCCC4)OC(=O)C56CC7CC(C5)CC(C7)C6

Isomeric SMILES

COC1=C(C=CC(=C1)C2=C(N3C=CC=CC3=N2)NC4CCCCC4)OC(=O)C56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C31H37N3O3/c1-36-26-16-23(28-29(32-24-7-3-2-4-8-24)34-12-6-5-9-27(34)33-28)10-11-25(26)37-30(35)31-17-20-13-21(18-31)15-22(14-20)19-31/h5-6,9-12,16,20-22,24,32H,2-4,7-8,13-15,17-19H2,1H3