N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazole-4-carboxamide

Systemtic Name: N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazole-4-carboxamide Openeye Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazole-4-carboxamide CAS Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1-[(2-chlorophenyl)methyl]-3,5-dimethyl-4-pyrazolecarboxamide IUPAC Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazole-4-carboxamide Traditional Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1-(2-chlorobenzyl)-3,5-dimethyl-pyrazole-4-carboxamide Formula: C21H19BrClN3O3 MolecularWeight: 476.75086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2Cl)C)C(=O)NC3=CC4=C(C=C3Br)OCCO4

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2Cl)C)C(=O)NC3=CC4=C(C=C3Br)OCCO4

InChI

InChI=1S/C21H19BrClN3O3/c1-12-20(13(2)26(25-12)11-14-5-3-4-6-16(14)23)21(27)24-17-10-19-18(9-15(17)22)28-7-8-29-19/h3-6,9-10H,7-8,11H2,1-2H3,(H,24,27)