9-methyl-N-(1-pyrazol-1-ylpropan-2-yl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine

Systemtic Name: 9-methyl-N-(1-pyrazol-1-ylpropan-2-yl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine Openeye Name: 9-methyl-N-(1-methyl-2-pyrazol-1-yl-ethyl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine CAS Name: 9-methyl-N-[1-(1-pyrazolyl)propan-2-yl]-2,3,4,5-tetrahydro-1-benzoxepin-5-amine IUPAC Name: 9-methyl-N-(1-pyrazol-1-ylpropan-2-yl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine Traditional Name: (1-methyl-2-pyrazol-1-yl-ethyl)-(9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amine Formula: C17H23N3O MolecularWeight: 285.38402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1OCCCC2NC(C)CN3C=CC=N3

Isomeric SMILES

CC1=CC=CC2=C1OCCCC2NC(C)CN3C=CC=N3

InChI

InChI=1S/C17H23N3O/c1-13-6-3-7-15-16(8-4-11-21-17(13)15)19-14(2)12-20-10-5-9-18-20/h3,5-7,9-10,14,16,19H,4,8,11-12H2,1-2H3