(3-carbazol-9-yl-3-oxidanylidene-propyl) 2-phenyl-3H-benzimidazole-5-carboxylate

Systemtic Name: (3-carbazol-9-yl-3-oxidanylidene-propyl) 2-phenyl-3H-benzimidazole-5-carboxylate Openeye Name: (3-carbazol-9-yl-3-oxo-propyl) 2-phenyl-3H-benzimidazole-5-carboxylate CAS Name: 2-phenyl-3H-benzimidazole-5-carboxylic acid [3-(9-carbazolyl)-3-oxopropyl] ester IUPAC Name: (3-carbazol-9-yl-3-oxopropyl) 2-phenyl-3H-benzimidazole-5-carboxylate Traditional Name: 2-phenyl-3H-benzimidazole-5-carboxylic acid (3-carbazol-9-yl-3-keto-propyl) ester Formula: C29H21N3O3 MolecularWeight: 459.49534

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)C(=O)OCCC(=O)N4C5=CC=CC=C5C6=CC=CC=C64

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)C(=O)OCCC(=O)N4C5=CC=CC=C5C6=CC=CC=C64

InChI

InChI=1S/C29H21N3O3/c33-27(32-25-12-6-4-10-21(25)22-11-5-7-13-26(22)32)16-17-35-29(34)20-14-15-23-24(18-20)31-28(30-23)19-8-2-1-3-9-19/h1-15,18H,16-17H2,(H,30,31)