azepan-1-ium; N'-butyl-2-(4-chloranylphenoxy)ethanehydrazide; chloride

Systemtic Name: azepan-1-ium; N'-butyl-2-(4-chloranylphenoxy)ethanehydrazide; chloride Openeye Name: azepan-1-ium; N'-butyl-2-(4-chlorophenoxy)acetohydrazide; chloride CAS Name: azepan-1-ium; N'-butyl-2-(4-chlorophenoxy)acetohydrazide; chloride IUPAC Name: azepan-1-ium; N'-butyl-2-(4-chlorophenoxy)acetohydrazide; chloride Traditional Name: azepan-1-ium; N'-butyl-2-(4-chlorophenoxy)acetohydrazide; chloride Formula: C18H31Cl2N3O2 MolecularWeight: 392.36364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNNC(=O)COC1=CC=C(C=C1)Cl.C1CCC[NH2+]CC1.[Cl-]

Isomeric SMILES

CCCCNNC(=O)COC1=CC=C(C=C1)Cl.C1CCC[NH2+]CC1.[Cl-]

InChI

InChI=1S/C12H17ClN2O2.C6H13N.ClH/c1-2-3-8-14-15-12(16)9-17-11-6-4-10(13)5-7-11;1-2-4-6-7-5-3-1;/h4-7,14H,2-3,8-9H2,1H3,(H,15,16);7H,1-6H2;1H