3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 4-(2,5-dimethylpyrrol-1-yl)benzoate

Systemtic Name: 3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 4-(2,5-dimethylpyrrol-1-yl)benzoate Openeye Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 4-(2,5-dimethylpyrrol-1-yl)benzoate CAS Name: 4-(2,5-dimethyl-1-pyrrolyl)benzoic acid 3-(2-oxo-3H-benzimidazol-1-yl)propyl ester IUPAC Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 4-(2,5-dimethylpyrrol-1-yl)benzoate Traditional Name: 4-(2,5-dimethylpyrrol-1-yl)benzoic acid 3-(2-keto-3H-benzimidazol-1-yl)propyl ester Formula: C23H23N3O3 MolecularWeight: 389.44702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)OCCCN3C4=CC=CC=C4NC3=O)C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)OCCCN3C4=CC=CC=C4NC3=O)C

InChI

InChI=1S/C23H23N3O3/c1-16-8-9-17(2)26(16)19-12-10-18(11-13-19)22(27)29-15-5-14-25-21-7-4-3-6-20(21)24-23(25)28/h3-4,6-13H,5,14-15H2,1-2H3,(H,24,28)