N-(1H-benzimidazol-2-ylmethyl)-1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-4-oxidanyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(1H-benzimidazol-2-ylmethyl)-1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-4-oxidanyl-pyrrolidine-2-carboxamide Openeye Name: N-(1H-benzimidazol-2-ylmethyl)-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-4-hydroxy-pyrrolidine-2-carboxamide CAS Name: N-(1H-benzimidazol-2-ylmethyl)-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-4-hydroxy-2-pyrrolidinecarboxamide IUPAC Name: N-(1H-benzimidazol-2-ylmethyl)-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-4-hydroxypyrrolidine-2-carboxamide Traditional Name: N-(1H-benzimidazol-2-ylmethyl)-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-4-hydroxy-pyrrolidine-2-carboxamide Formula: C21H21ClN4O4 MolecularWeight: 428.86884

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=O)NCC2=NC3=CC=CC=C3N2)CC4=CC5=C(C=C4Cl)OCO5)O

Isomeric SMILES

C1C(CN(C1C(=O)NCC2=NC3=CC=CC=C3N2)CC4=CC5=C(C=C4Cl)OCO5)O

InChI

InChI=1S/C21H21ClN4O4/c22-14-7-19-18(29-11-30-19)5-12(14)9-26-10-13(27)6-17(26)21(28)23-8-20-24-15-3-1-2-4-16(15)25-20/h1-5,7,13,17,27H,6,8-11H2,(H,23,28)(H,24,25)