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

Systemtic Name: [2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 2-chloranyl-4-nitro-benzoate Openeye Name: [2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 2-chloro-4-nitro-benzoate CAS Name: 2-chloro-4-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] 2-chloro-4-nitrobenzoate Traditional Name: 2-chloro-4-nitro-benzoic acid [2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] ester Formula: C26H23ClN4O4 MolecularWeight: 490.93822

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H23ClN4O4/c27-21-16-18(31(33)34)13-14-19(21)26(32)35-22-11-5-4-10-20(22)24-25(28-17-8-2-1-3-9-17)30-15-7-6-12-23(30)29-24/h4-7,10-17,28H,1-3,8-9H2