1-(4-bromophenyl)carbonyl-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-piperidine-4-carboxamide

Systemtic Name: 1-(4-bromophenyl)carbonyl-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-piperidine-4-carboxamide Openeye Name: 1-(4-bromobenzoyl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-piperidine-4-carboxamide CAS Name: 1-[(4-bromophenyl)-oxomethyl]-N-(5-spiro[1,3-benzodioxole-2,1'-cyclohexane]yl)-4-piperidinecarboxamide IUPAC Name: 1-(4-bromobenzoyl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-ylpiperidine-4-carboxamide Traditional Name: 1-(4-bromobenzoyl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-isonipecotamide Formula: C25H27BrN2O4 MolecularWeight: 499.39688

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)OC3=C(O2)C=C(C=C3)NC(=O)C4CCN(CC4)C(=O)C5=CC=C(C=C5)Br

Isomeric SMILES

C1CCC2(CC1)OC3=C(O2)C=C(C=C3)NC(=O)C4CCN(CC4)C(=O)C5=CC=C(C=C5)Br

InChI

InChI=1S/C25H27BrN2O4/c26-19-6-4-18(5-7-19)24(30)28-14-10-17(11-15-28)23(29)27-20-8-9-21-22(16-20)32-25(31-21)12-2-1-3-13-25/h4-9,16-17H,1-3,10-15H2,(H,27,29)