[2-[3-(2,4,4-trimethylpentan-2-ylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 4-chloranylbenzoate

Systemtic Name: [2-[3-(2,4,4-trimethylpentan-2-ylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 4-chloranylbenzoate Openeye Name: [2-[3-(1,1,3,3-tetramethylbutylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [2-[3-(2,4,4-trimethylpentan-2-ylamino)-2-imidazo[1,2-a]pyridinyl]phenyl] ester IUPAC Name: [2-[3-(2,4,4-trimethylpentan-2-ylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [2-[3-(1,1,3,3-tetramethylbutylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] ester Formula: C28H30ClN3O2 MolecularWeight: 476.0097

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)NC1=C(N=C2N1C=CC=C2)C3=CC=CC=C3OC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C)(C)CC(C)(C)NC1=C(N=C2N1C=CC=C2)C3=CC=CC=C3OC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C28H30ClN3O2/c1-27(2,3)18-28(4,5)31-25-24(30-23-12-8-9-17-32(23)25)21-10-6-7-11-22(21)34-26(33)19-13-15-20(29)16-14-19/h6-17,31H,18H2,1-5H3