N-[2,6-bis(bromanyl)-4-propan-2-yl-phenyl]-4-(2,3-dihydro-1,4-benzodioxin-3-ylcarbonyl)piperazine-1-carboxamide

Systemtic Name: N-[2,6-bis(bromanyl)-4-propan-2-yl-phenyl]-4-(2,3-dihydro-1,4-benzodioxin-3-ylcarbonyl)piperazine-1-carboxamide Openeye Name: N-(2,6-dibromo-4-isopropyl-phenyl)-4-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)piperazine-1-carboxamide CAS Name: N-(2,6-dibromo-4-propan-2-ylphenyl)-4-[2,3-dihydro-1,4-benzodioxin-3-yl(oxo)methyl]-1-piperazinecarboxamide IUPAC Name: N-(2,6-dibromo-4-propan-2-ylphenyl)-4-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)piperazine-1-carboxamide Traditional Name: N-(2,6-dibromo-4-isopropyl-phenyl)-4-(2,3-dihydro-1,4-benzodioxin-3-carbonyl)piperazine-1-carboxamide Formula: C23H25Br2N3O4 MolecularWeight: 567.2703

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C(=C1)Br)NC(=O)N2CCN(CC2)C(=O)C3COC4=CC=CC=C4O3)Br

Isomeric SMILES

CC(C)C1=CC(=C(C(=C1)Br)NC(=O)N2CCN(CC2)C(=O)C3COC4=CC=CC=C4O3)Br

InChI

InChI=1S/C23H25Br2N3O4/c1-14(2)15-11-16(24)21(17(25)12-15)26-23(30)28-9-7-27(8-10-28)22(29)20-13-31-18-5-3-4-6-19(18)32-20/h3-6,11-12,14,20H,7-10,13H2,1-2H3,(H,26,30)