2-[4-(phenylcarbonyl)piperazin-1-yl]-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-ethanamide

Systemtic Name: 2-[4-(phenylcarbonyl)piperazin-1-yl]-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-ethanamide Openeye Name: 2-(4-benzoylpiperazin-1-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-acetamide CAS Name: 2-(4-benzoyl-1-piperazinyl)-N-(5-spiro[1,3-benzodioxole-2,1'-cyclohexane]yl)acetamide IUPAC Name: 2-(4-benzoylpiperazin-1-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-ylacetamide Traditional Name: 2-(4-benzoylpiperazino)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-acetamide Formula: C25H29N3O4 MolecularWeight: 435.51546

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)OC3=C(O2)C=C(C=C3)NC(=O)CN4CCN(CC4)C(=O)C5=CC=CC=C5

Isomeric SMILES

C1CCC2(CC1)OC3=C(O2)C=C(C=C3)NC(=O)CN4CCN(CC4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C25H29N3O4/c29-23(18-27-13-15-28(16-14-27)24(30)19-7-3-1-4-8-19)26-20-9-10-21-22(17-20)32-25(31-21)11-5-2-6-12-25/h1,3-4,7-10,17H,2,5-6,11-16,18H2,(H,26,29)