3-ethyl-4-[1-(3-iodanylphenyl)carbonylpiperidin-4-yl]-1-piperidin-4-yl-benzimidazol-2-one

Systemtic Name: 3-ethyl-4-[1-(3-iodanylphenyl)carbonylpiperidin-4-yl]-1-piperidin-4-yl-benzimidazol-2-one Openeye Name: 3-ethyl-4-[1-(3-iodobenzoyl)-4-piperidyl]-1-(4-piperidyl)benzimidazol-2-one CAS Name: 3-ethyl-4-[1-[(3-iodophenyl)-oxomethyl]-4-piperidinyl]-1-(4-piperidinyl)-2-benzimidazolone IUPAC Name: 3-ethyl-4-[1-(3-iodobenzoyl)piperidin-4-yl]-1-piperidin-4-ylbenzimidazol-2-one Traditional Name: 3-ethyl-4-[1-(3-iodobenzoyl)-4-piperidyl]-1-(4-piperidyl)benzimidazol-2-one Formula: C26H31IN4O2 MolecularWeight: 558.45441

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC=C2N(C1=O)C3CCNCC3)C4CCN(CC4)C(=O)C5=CC(=CC=C5)I

Isomeric SMILES

CCN1C2=C(C=CC=C2N(C1=O)C3CCNCC3)C4CCN(CC4)C(=O)C5=CC(=CC=C5)I

InChI

InChI=1S/C26H31IN4O2/c1-2-30-24-22(7-4-8-23(24)31(26(30)33)21-9-13-28-14-10-21)18-11-15-29(16-12-18)25(32)19-5-3-6-20(27)17-19/h3-8,17-18,21,28H,2,9-16H2,1H3