N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]yl)-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-4-(1,2,4-triazol-1-yl)benzamide Formula: C20H18N4O3 MolecularWeight: 362.38192

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC(=O)C4=CC=C(C=C4)N5C=NC=N5

Isomeric SMILES

C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC(=O)C4=CC=C(C=C4)N5C=NC=N5

InChI

InChI=1S/C20H18N4O3/c25-19(14-3-6-16(7-4-14)24-13-21-12-22-24)23-15-5-8-17-18(11-15)27-20(26-17)9-1-2-10-20/h3-8,11-13H,1-2,9-10H2,(H,23,25)