N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-1-butyl-5-chloranyl-3-methyl-pyrazole-4-carboxamide

Systemtic Name: N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-1-butyl-5-chloranyl-3-methyl-pyrazole-4-carboxamide Openeye Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1-butyl-5-chloro-3-methyl-pyrazole-4-carboxamide CAS Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1-butyl-5-chloro-3-methyl-4-pyrazolecarboxamide IUPAC Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1-butyl-5-chloro-3-methylpyrazole-4-carboxamide Traditional Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1-butyl-5-chloro-3-methyl-pyrazole-4-carboxamide Formula: C17H19BrClN3O3 MolecularWeight: 428.70806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C(=O)NC2=CC3=C(C=C2Br)OCCO3)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)C(=O)NC2=CC3=C(C=C2Br)OCCO3)Cl

InChI

InChI=1S/C17H19BrClN3O3/c1-3-4-5-22-16(19)15(10(2)21-22)17(23)20-12-9-14-13(8-11(12)18)24-6-7-25-14/h8-9H,3-7H2,1-2H3,(H,20,23)