N-[(1-methyl-3-propan-2-yl-pyrazol-4-yl)methyl]-2,3-dihydro-1,4-benzodioxin-6-amine

Systemtic Name: N-[(1-methyl-3-propan-2-yl-pyrazol-4-yl)methyl]-2,3-dihydro-1,4-benzodioxin-6-amine Openeye Name: N-[(3-isopropyl-1-methyl-pyrazol-4-yl)methyl]-2,3-dihydro-1,4-benzodioxin-6-amine CAS Name: N-[(1-methyl-3-propan-2-yl-4-pyrazolyl)methyl]-2,3-dihydro-1,4-benzodioxin-6-amine IUPAC Name: N-[(1-methyl-3-propan-2-ylpyrazol-4-yl)methyl]-2,3-dihydro-1,4-benzodioxin-6-amine Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[(3-isopropyl-1-methyl-pyrazol-4-yl)methyl]amine Formula: C16H21N3O2 MolecularWeight: 287.35684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN(C=C1CNC2=CC3=C(C=C2)OCCO3)C

Isomeric SMILES

CC(C)C1=NN(C=C1CNC2=CC3=C(C=C2)OCCO3)C

InChI

InChI=1S/C16H21N3O2/c1-11(2)16-12(10-19(3)18-16)9-17-13-4-5-14-15(8-13)21-7-6-20-14/h4-5,8,10-11,17H,6-7,9H2,1-3H3