N-[(1-methylpyrazol-4-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine

Systemtic Name: N-[(1-methylpyrazol-4-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine Openeye Name: N-[(1-methylpyrazol-4-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine CAS Name: N-[(1-methyl-4-pyrazolyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine IUPAC Name: N-[(1-methylpyrazol-4-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine Traditional Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-[(1-methylpyrazol-4-yl)methyl]amine Formula: C14H17N3O2 MolecularWeight: 259.30368

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CNC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CN1C=C(C=N1)CNC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C14H17N3O2/c1-17-10-11(9-16-17)8-15-12-3-4-13-14(7-12)19-6-2-5-18-13/h3-4,7,9-10,15H,2,5-6,8H2,1H3