2-diethylaminoethyl (1E)-4-bromanyl-N-oxidanyl-benzenecarboximidothioate; nitric acid

Systemtic Name: 2-diethylaminoethyl (1E)-4-bromanyl-N-oxidanyl-benzenecarboximidothioate; nitric acid Openeye Name: 2-diethylaminoethyl (1E)-4-bromo-N-hydroxy-benzenecarboximidothioate; nitric acid CAS Name: (1E)-4-bromo-N-hydroxybenzenecarboximidothioic acid 2-diethylaminoethyl ester; nitric acid IUPAC Name: 2-diethylaminoethyl (1E)-4-bromo-N-hydroxybenzenecarboximidothioate; nitric acid Traditional Name: (1E)-4-bromo-N-hydroxy-benzenecarboximidothioic acid 2-diethylaminoethyl ester; nitric acid Formula: C13H20BrN3O4S MolecularWeight: 394.2846

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCSC(=NO)C1=CC=C(C=C1)Br.[N+](=O)(O)[O-]

Isomeric SMILES

CCN(CC)CCS/C(=N/O)/C1=CC=C(C=C1)Br.[N+](=O)(O)[O-]

InChI

InChI=1S/C13H19BrN2OS.HNO3/c1-3-16(4-2)9-10-18-13(15-17)11-5-7-12(14)8-6-11;2-1(3)4/h5-8,17H,3-4,9-10H2,1-2H3;(H,2,3,4)/b15-13+;