2-[4-(4,6-dimethyl-2-phenyl-imidazo[4,5-c]pyridin-1-yl)phenyl]ethyl benzoate

Systemtic Name: 2-[4-(4,6-dimethyl-2-phenyl-imidazo[4,5-c]pyridin-1-yl)phenyl]ethyl benzoate Openeye Name: 2-[4-(4,6-dimethyl-2-phenyl-imidazo[4,5-c]pyridin-1-yl)phenyl]ethyl benzoate CAS Name: benzoic acid 2-[4-(4,6-dimethyl-2-phenyl-1-imidazo[4,5-c]pyridinyl)phenyl]ethyl ester IUPAC Name: 2-[4-(4,6-dimethyl-2-phenylimidazo[4,5-c]pyridin-1-yl)phenyl]ethyl benzoate Traditional Name: benzoic acid 2-[4-(4,6-dimethyl-2-phenyl-imidazo[4,5-c]pyridin-1-yl)phenyl]ethyl ester Formula: C29H25N3O2 MolecularWeight: 447.5277

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C(=C1)N(C(=N2)C3=CC=CC=C3)C4=CC=C(C=C4)CCOC(=O)C5=CC=CC=C5)C

Isomeric SMILES

CC1=NC(=C2C(=C1)N(C(=N2)C3=CC=CC=C3)C4=CC=C(C=C4)CCOC(=O)C5=CC=CC=C5)C

InChI

InChI=1S/C29H25N3O2/c1-20-19-26-27(21(2)30-20)31-28(23-9-5-3-6-10-23)32(26)25-15-13-22(14-16-25)17-18-34-29(33)24-11-7-4-8-12-24/h3-16,19H,17-18H2,1-2H3