[(2S)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-(3-chloranyl-4,5-dimethoxy-phenyl)methanone

Systemtic Name: [(2S)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-(3-chloranyl-4,5-dimethoxy-phenyl)methanone Openeye Name: [(2S)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-(3-chloro-4,5-dimethoxy-phenyl)methanone CAS Name: [(2S)-2-(1H-benzimidazol-2-yl)-1-pyrrolidinyl]-(3-chloro-4,5-dimethoxyphenyl)methanone IUPAC Name: [(2S)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-(3-chloro-4,5-dimethoxyphenyl)methanone Traditional Name: [(2S)-2-(1H-benzimidazol-2-yl)pyrrolidino]-(3-chloro-4,5-dimethoxy-phenyl)methanone Formula: C20H20ClN3O3 MolecularWeight: 385.8441

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)N2CCCC2C3=NC4=CC=CC=C4N3)Cl)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)N2CCC[C@H]2C3=NC4=CC=CC=C4N3)Cl)OC

InChI

InChI=1S/C20H20ClN3O3/c1-26-17-11-12(10-13(21)18(17)27-2)20(25)24-9-5-8-16(24)19-22-14-6-3-4-7-15(14)23-19/h3-4,6-7,10-11,16H,5,8-9H2,1-2H3,(H,22,23)/t16-/m0/s1