4-bromanyl-3,5-dimethoxy-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-benzamide

Systemtic Name: 4-bromanyl-3,5-dimethoxy-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-benzamide Openeye Name: 4-bromo-3,5-dimethoxy-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-benzamide CAS Name: 4-bromo-3,5-dimethoxy-N-(5-spiro[1,3-benzodioxole-2,1'-cyclohexane]yl)benzamide IUPAC Name: 4-bromo-3,5-dimethoxy-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-ylbenzamide Traditional Name: 4-bromo-3,5-dimethoxy-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-benzamide Formula: C21H22BrNO5 MolecularWeight: 448.30708

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1Br)OC)C(=O)NC2=CC3=C(C=C2)OC4(O3)CCCCC4

Isomeric SMILES

COC1=CC(=CC(=C1Br)OC)C(=O)NC2=CC3=C(C=C2)OC4(O3)CCCCC4

InChI

InChI=1S/C21H22BrNO5/c1-25-17-10-13(11-18(26-2)19(17)22)20(24)23-14-6-7-15-16(12-14)28-21(27-15)8-4-3-5-9-21/h6-7,10-12H,3-5,8-9H2,1-2H3,(H,23,24)