N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-1H-pyrazol-4-amine

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-1H-pyrazol-4-amine Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-1H-pyrazol-4-amine CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-1H-pyrazol-4-amine IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-1H-pyrazol-4-amine Traditional Name: 3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl(1H-pyrazol-4-yl)amine Formula: C13H15N3O2 MolecularWeight: 245.2771

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC(=C2OC1)CNC3=CNN=C3

Isomeric SMILES

C1COC2=CC=CC(=C2OC1)CNC3=CNN=C3

InChI

InChI=1S/C13H15N3O2/c1-3-10(7-14-11-8-15-16-9-11)13-12(4-1)17-5-2-6-18-13/h1,3-4,8-9,14H,2,5-7H2,(H,15,16)