(1-carbazol-9-yl-1-oxidanylidene-propan-2-yl) 2-pyridin-3-yl-3H-benzimidazole-5-carboxylate

Systemtic Name: (1-carbazol-9-yl-1-oxidanylidene-propan-2-yl) 2-pyridin-3-yl-3H-benzimidazole-5-carboxylate Openeye Name: (2-carbazol-9-yl-1-methyl-2-oxo-ethyl) 2-(3-pyridyl)-3H-benzimidazole-5-carboxylate CAS Name: 2-(3-pyridinyl)-3H-benzimidazole-5-carboxylic acid [1-(9-carbazolyl)-1-oxopropan-2-yl] ester IUPAC Name: (1-carbazol-9-yl-1-oxopropan-2-yl) 2-pyridin-3-yl-3H-benzimidazole-5-carboxylate Traditional Name: 2-(3-pyridyl)-3H-benzimidazole-5-carboxylic acid (2-carbazol-9-yl-2-keto-1-methyl-ethyl) ester Formula: C28H20N4O3 MolecularWeight: 460.4834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1C2=CC=CC=C2C3=CC=CC=C31)OC(=O)C4=CC5=C(C=C4)N=C(N5)C6=CN=CC=C6

Isomeric SMILES

CC(C(=O)N1C2=CC=CC=C2C3=CC=CC=C31)OC(=O)C4=CC5=C(C=C4)N=C(N5)C6=CN=CC=C6

InChI

InChI=1S/C28H20N4O3/c1-17(27(33)32-24-10-4-2-8-20(24)21-9-3-5-11-25(21)32)35-28(34)18-12-13-22-23(15-18)31-26(30-22)19-7-6-14-29-16-19/h2-17H,1H3,(H,30,31)