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

Systemtic Name: N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine Openeye Name: N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine CAS Name: N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine IUPAC Name: N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine Traditional Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]amine Formula: C15H19N3O2 MolecularWeight: 273.33026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)CNC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC1=C(C(=NN1)C)CNC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C15H19N3O2/c1-10-13(11(2)18-17-10)9-16-12-4-5-14-15(8-12)20-7-3-6-19-14/h4-5,8,16H,3,6-7,9H2,1-2H3,(H,17,18)