3-(1H-benzimidazol-2-yl)-1-[2-(3-chloranyl-2,6-dimethoxy-phenyl)carbonylpyrazolidin-1-yl]propan-1-one

Systemtic Name: 3-(1H-benzimidazol-2-yl)-1-[2-(3-chloranyl-2,6-dimethoxy-phenyl)carbonylpyrazolidin-1-yl]propan-1-one Openeye Name: 3-(1H-benzimidazol-2-yl)-1-[2-(3-chloro-2,6-dimethoxy-benzoyl)pyrazolidin-1-yl]propan-1-one CAS Name: 3-(1H-benzimidazol-2-yl)-1-[2-[(3-chloro-2,6-dimethoxyphenyl)-oxomethyl]-1-pyrazolidinyl]-1-propanone IUPAC Name: 3-(1H-benzimidazol-2-yl)-1-[2-(3-chloro-2,6-dimethoxybenzoyl)pyrazolidin-1-yl]propan-1-one Traditional Name: 3-(1H-benzimidazol-2-yl)-1-[2-(3-chloro-2,6-dimethoxy-benzoyl)pyrazolidin-1-yl]propan-1-one Formula: C22H23ClN4O4 MolecularWeight: 442.89542

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)Cl)OC)C(=O)N2CCCN2C(=O)CCC3=NC4=CC=CC=C4N3

Isomeric SMILES

COC1=C(C(=C(C=C1)Cl)OC)C(=O)N2CCCN2C(=O)CCC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C22H23ClN4O4/c1-30-17-9-8-14(23)21(31-2)20(17)22(29)27-13-5-12-26(27)19(28)11-10-18-24-15-6-3-4-7-16(15)25-18/h3-4,6-9H,5,10-13H2,1-2H3,(H,24,25)