1-(3-bromophenyl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-(3-bromophenyl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-1,2,3-triazole-4-carboxamide Openeye Name: 1-(3-bromophenyl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-triazole-4-carboxamide CAS Name: 1-(3-bromophenyl)-N-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]yl)-4-triazolecarboxamide IUPAC Name: 1-(3-bromophenyl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yltriazole-4-carboxamide Traditional Name: 1-(3-bromophenyl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-triazole-4-carboxamide Formula: C20H17BrN4O3 MolecularWeight: 441.27798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC(=O)C4=CN(N=N4)C5=CC(=CC=C5)Br

Isomeric SMILES

C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC(=O)C4=CN(N=N4)C5=CC(=CC=C5)Br

InChI

InChI=1S/C20H17BrN4O3/c21-13-4-3-5-15(10-13)25-12-16(23-24-25)19(26)22-14-6-7-17-18(11-14)28-20(27-17)8-1-2-9-20/h3-7,10-12H,1-2,8-9H2,(H,22,26)