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

Systemtic Name: [2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 3-nitrobenzoate Openeye Name: [2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [2-[3-(cyclohexylamino)-2-imidazo[1,2-a]pyridinyl]phenyl] ester IUPAC Name: [2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] ester Formula: C26H24N4O4 MolecularWeight: 456.49316

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=C(N=C3N2C=CC=C3)C4=CC=CC=C4OC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)NC2=C(N=C3N2C=CC=C3)C4=CC=CC=C4OC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C26H24N4O4/c31-26(18-9-8-12-20(17-18)30(32)33)34-22-14-5-4-13-21(22)24-25(27-19-10-2-1-3-11-19)29-16-7-6-15-23(29)28-24/h4-9,12-17,19,27H,1-3,10-11H2