[(3E)-3-azanyl-3-(phenylcarbonyloxyimino)propyl]-dipentyl-azanium chloride

Systemtic Name: [(3E)-3-azanyl-3-(phenylcarbonyloxyimino)propyl]-dipentyl-azanium chloride Openeye Name: [(3E)-3-amino-3-benzoyloxyimino-propyl]-dipentyl-ammonium chloride CAS Name: [(3E)-3-amino-3-benzoyloxyiminopropyl]-dipentylammonium chloride IUPAC Name: [(3E)-3-amino-3-benzoyloxyiminopropyl]-dipentylazanium chloride Traditional Name: [(3E)-3-amino-3-benzoyloximino-propyl]-diamyl-ammonium chloride Formula: C20H34ClN3O2 MolecularWeight: 383.95586

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[NH+](CCCCC)CCC(=NOC(=O)C1=CC=CC=C1)N.[Cl-]

Isomeric SMILES

CCCCC[NH+](CCCCC)CC/C(=N\OC(=O)C1=CC=CC=C1)/N.[Cl-]

InChI

InChI=1S/C20H33N3O2.ClH/c1-3-5-10-15-23(16-11-6-4-2)17-14-19(21)22-25-20(24)18-12-8-7-9-13-18;/h7-9,12-13H,3-6,10-11,14-17H2,1-2H3,(H2,21,22);1H