N-(8-bromanyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-3,5-dimethyl-1H-pyrazol-4-amine

Systemtic Name: N-(8-bromanyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-3,5-dimethyl-1H-pyrazol-4-amine Openeye Name: N-(8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-3,5-dimethyl-1H-pyrazol-4-amine CAS Name: N-(8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-3,5-dimethyl-1H-pyrazol-4-amine IUPAC Name: N-(8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-3,5-dimethyl-1H-pyrazol-4-amine Traditional Name: (8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-(3,5-dimethyl-1H-pyrazol-4-yl)amine Formula: C15H18BrN3O MolecularWeight: 336.22692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)NC2CCCOC3=C2C=CC(=C3)Br

Isomeric SMILES

CC1=C(C(=NN1)C)NC2CCCOC3=C2C=CC(=C3)Br

InChI

InChI=1S/C15H18BrN3O/c1-9-15(10(2)19-18-9)17-13-4-3-7-20-14-8-11(16)5-6-12(13)14/h5-6,8,13,17H,3-4,7H2,1-2H3,(H,18,19)