[1-(2,3-dihydroindol-1-yl)-1-oxidanylidene-butan-2-yl] 2-(4-methoxyphenyl)-3H-benzimidazole-5-carboxylate

Systemtic Name: [1-(2,3-dihydroindol-1-yl)-1-oxidanylidene-butan-2-yl] 2-(4-methoxyphenyl)-3H-benzimidazole-5-carboxylate Openeye Name: 1-(indoline-1-carbonyl)propyl 2-(4-methoxyphenyl)-3H-benzimidazole-5-carboxylate CAS Name: 2-(4-methoxyphenyl)-3H-benzimidazole-5-carboxylic acid [1-(2,3-dihydroindol-1-yl)-1-oxobutan-2-yl] ester IUPAC Name: [1-(2,3-dihydroindol-1-yl)-1-oxobutan-2-yl] 2-(4-methoxyphenyl)-3H-benzimidazole-5-carboxylate Traditional Name: 2-(4-methoxyphenyl)-3H-benzimidazole-5-carboxylic acid 1-(indoline-1-carbonyl)propyl ester Formula: C27H25N3O4 MolecularWeight: 455.5051

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCC2=CC=CC=C21)OC(=O)C3=CC4=C(C=C3)N=C(N4)C5=CC=C(C=C5)OC

Isomeric SMILES

CCC(C(=O)N1CCC2=CC=CC=C21)OC(=O)C3=CC4=C(C=C3)N=C(N4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C27H25N3O4/c1-3-24(26(31)30-15-14-17-6-4-5-7-23(17)30)34-27(32)19-10-13-21-22(16-19)29-25(28-21)18-8-11-20(33-2)12-9-18/h4-13,16,24H,3,14-15H2,1-2H3,(H,28,29)