5-butan-2-yl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-pyrazol-3-amine

Systemtic Name: 5-butan-2-yl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-pyrazol-3-amine Openeye Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-5-sec-butyl-pyrazol-3-amine CAS Name: 5-butan-2-yl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-3-pyrazolamine IUPAC Name: 5-butan-2-yl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpyrazol-3-amine Traditional Name: [4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-5-sec-butyl-pyrazol-3-yl]amine Formula: C16H21N3O2 MolecularWeight: 287.35684

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=NN(C(=C1C2=CC3=C(C=C2)OCCO3)N)C

Isomeric SMILES

CCC(C)C1=NN(C(=C1C2=CC3=C(C=C2)OCCO3)N)C

InChI

InChI=1S/C16H21N3O2/c1-4-10(2)15-14(16(17)19(3)18-15)11-5-6-12-13(9-11)21-8-7-20-12/h5-6,9-10H,4,7-8,17H2,1-3H3