3-(3-chloranylpropyl)-7-(2-methylpyrazol-3-yl)-1,2,4,5-tetrahydro-3-benzazepine

Systemtic Name: 3-(3-chloranylpropyl)-7-(2-methylpyrazol-3-yl)-1,2,4,5-tetrahydro-3-benzazepine Openeye Name: 3-(3-chloropropyl)-7-(2-methylpyrazol-3-yl)-1,2,4,5-tetrahydro-3-benzazepine CAS Name: 3-(3-chloropropyl)-7-(2-methyl-3-pyrazolyl)-1,2,4,5-tetrahydro-3-benzazepine IUPAC Name: 3-(3-chloropropyl)-7-(2-methylpyrazol-3-yl)-1,2,4,5-tetrahydro-3-benzazepine Traditional Name: 3-(3-chloropropyl)-7-(2-methylpyrazol-3-yl)-1,2,4,5-tetrahydro-3-benzazepine Formula: C17H22ClN3 MolecularWeight: 303.82968

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)C2=CC3=C(CCN(CC3)CCCCl)C=C2

Isomeric SMILES

CN1C(=CC=N1)C2=CC3=C(CCN(CC3)CCCCl)C=C2

InChI

InChI=1S/C17H22ClN3/c1-20-17(5-9-19-20)16-4-3-14-6-11-21(10-2-8-18)12-7-15(14)13-16/h3-5,9,13H,2,6-8,10-12H2,1H3