4-(1,3-benzodioxol-5-yl)-2-methyl-5-pentan-2-yl-pyrazol-3-amine

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-2-methyl-5-pentan-2-yl-pyrazol-3-amine Openeye Name: 4-(1,3-benzodioxol-5-yl)-2-methyl-5-(1-methylbutyl)pyrazol-3-amine CAS Name: 4-(1,3-benzodioxol-5-yl)-2-methyl-5-pentan-2-yl-3-pyrazolamine IUPAC Name: 4-(1,3-benzodioxol-5-yl)-2-methyl-5-pentan-2-ylpyrazol-3-amine Traditional Name: [4-(1,3-benzodioxol-5-yl)-2-methyl-5-(1-methylbutyl)pyrazol-3-yl]amine Formula: C16H21N3O2 MolecularWeight: 287.35684

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1=NN(C(=C1C2=CC3=C(C=C2)OCO3)N)C

Isomeric SMILES

CCCC(C)C1=NN(C(=C1C2=CC3=C(C=C2)OCO3)N)C

InChI

InChI=1S/C16H21N3O2/c1-4-5-10(2)15-14(16(17)19(3)18-15)11-6-7-12-13(8-11)21-9-20-12/h6-8,10H,4-5,9,17H2,1-3H3