[1-oxidanylidene-1-(1,2,3,4-tetrahydrocarbazol-9-yl)butan-2-yl] 2-pyridin-3-yl-3H-benzimidazole-5-carboxylate

Systemtic Name: [1-oxidanylidene-1-(1,2,3,4-tetrahydrocarbazol-9-yl)butan-2-yl] 2-pyridin-3-yl-3H-benzimidazole-5-carboxylate Openeye Name: 1-(1,2,3,4-tetrahydrocarbazole-9-carbonyl)propyl 2-(3-pyridyl)-3H-benzimidazole-5-carboxylate CAS Name: 2-(3-pyridinyl)-3H-benzimidazole-5-carboxylic acid [1-oxo-1-(1,2,3,4-tetrahydrocarbazol-9-yl)butan-2-yl] ester IUPAC Name: [1-oxo-1-(1,2,3,4-tetrahydrocarbazol-9-yl)butan-2-yl] 2-pyridin-3-yl-3H-benzimidazole-5-carboxylate Traditional Name: 2-(3-pyridyl)-3H-benzimidazole-5-carboxylic acid 1-(1,2,3,4-tetrahydrocarbazole-9-carbonyl)propyl ester Formula: C29H26N4O3 MolecularWeight: 478.54174

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1C2=C(CCCC2)C3=CC=CC=C31)OC(=O)C4=CC5=C(C=C4)N=C(N5)C6=CN=CC=C6

Isomeric SMILES

CCC(C(=O)N1C2=C(CCCC2)C3=CC=CC=C31)OC(=O)C4=CC5=C(C=C4)N=C(N5)C6=CN=CC=C6

InChI

InChI=1S/C29H26N4O3/c1-2-26(28(34)33-24-11-5-3-9-20(24)21-10-4-6-12-25(21)33)36-29(35)18-13-14-22-23(16-18)32-27(31-22)19-8-7-15-30-17-19/h3,5,7-9,11,13-17,26H,2,4,6,10,12H2,1H3,(H,31,32)