[(3-azanyl-4-chloranyl-phenyl)carbonyl-ethyl-amino]-dimethyl-azanium; butane; ethanamide; chloride

Systemtic Name: [(3-azanyl-4-chloranyl-phenyl)carbonyl-ethyl-amino]-dimethyl-azanium; butane; ethanamide; chloride Openeye Name: acetamide; [(3-amino-4-chloro-benzoyl)-ethyl-amino]-dimethyl-ammonium; butane; chloride CAS Name: acetamide; [[(3-amino-4-chlorophenyl)-oxomethyl]-ethylamino]-dimethylammonium; butane; chloride IUPAC Name: acetamide; [(3-amino-4-chlorobenzoyl)-ethylamino]-dimethylazanium; butane; chloride Traditional Name: acetamide; [(3-amino-4-chloro-benzoyl)-ethyl-amino]-dimethyl-ammonium; n-butane; chloride Formula: C17H32Cl2N4O2 MolecularWeight: 395.36758

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Descriptors Computed from Structure

Canonical SMILES:

CCCC.CCN(C(=O)C1=CC(=C(C=C1)Cl)N)[NH+](C)C.CC(=O)N.[Cl-]

Isomeric SMILES

CCCC.CCN(C(=O)C1=CC(=C(C=C1)Cl)N)[NH+](C)C.CC(=O)N.[Cl-]

InChI

InChI=1S/C11H16ClN3O.C4H10.C2H5NO.ClH/c1-4-15(14(2)3)11(16)8-5-6-9(12)10(13)7-8;1-3-4-2;1-2(3)4;/h5-7H,4,13H2,1-3H3;3-4H2,1-2H3;1H3,(H2,3,4);1H