1-(6-bromanyl-1H-benzimidazol-2-yl)-N-[(2,4-dimethoxyphenyl)methyl]piperidine-3-carboxamide

Systemtic Name: 1-(6-bromanyl-1H-benzimidazol-2-yl)-N-[(2,4-dimethoxyphenyl)methyl]piperidine-3-carboxamide Openeye Name: 1-(6-bromo-1H-benzimidazol-2-yl)-N-[(2,4-dimethoxyphenyl)methyl]piperidine-3-carboxamide CAS Name: 1-(6-bromo-1H-benzimidazol-2-yl)-N-[(2,4-dimethoxyphenyl)methyl]-3-piperidinecarboxamide IUPAC Name: 1-(6-bromo-1H-benzimidazol-2-yl)-N-[(2,4-dimethoxyphenyl)methyl]piperidine-3-carboxamide Traditional Name: 1-(6-bromo-1H-benzimidazol-2-yl)-N-(2,4-dimethoxybenzyl)nipecotamide Formula: C22H25BrN4O3 MolecularWeight: 473.3629

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CNC(=O)C2CCCN(C2)C3=NC4=C(N3)C=C(C=C4)Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CNC(=O)C2CCCN(C2)C3=NC4=C(N3)C=C(C=C4)Br)OC

InChI

InChI=1S/C22H25BrN4O3/c1-29-17-7-5-14(20(11-17)30-2)12-24-21(28)15-4-3-9-27(13-15)22-25-18-8-6-16(23)10-19(18)26-22/h5-8,10-11,15H,3-4,9,12-13H2,1-2H3,(H,24,28)(H,25,26)