1-(3-chloranylpropyl)-1,4-diazepane hydrate hydrochloride

Systemtic Name: 1-(3-chloranylpropyl)-1,4-diazepane hydrate hydrochloride Openeye Name: 1-(3-chloropropyl)-1,4-diazepane hydrate hydrochloride CAS Name: 1-(3-chloropropyl)-1,4-diazepane hydrate hydrochloride IUPAC Name: 1-(3-chloropropyl)-1,4-diazepane hydrate hydrochloride Traditional Name: 1-(3-chloropropyl)-1,4-diazepane hydrate hydrochloride Formula: C8H20Cl2N2O MolecularWeight: 231.1632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)CCCCl.O.Cl

Isomeric SMILES

C1CNCCN(C1)CCCCl.O.Cl

InChI

InChI=1S/C8H17ClN2.ClH.H2O/c9-3-1-6-11-7-2-4-10-5-8-11;;/h10H,1-8H2;1H;1H2