2-[(4-nitrophenyl)sulfanylmethyl]-N'-oxidanyl-benzenecarboximidamide

Systemtic Name: 2-[(4-nitrophenyl)sulfanylmethyl]-N'-oxidanyl-benzenecarboximidamide Openeye Name: N'-hydroxy-2-[(4-nitrophenyl)sulfanylmethyl]benzamidine CAS Name: N'-hydroxy-2-[[(4-nitrophenyl)thio]methyl]benzenecarboximidamide IUPAC Name: N'-hydroxy-2-[(4-nitrophenyl)sulfanylmethyl]benzenecarboximidamide Traditional Name: N'-hydroxy-2-[[(4-nitrophenyl)thio]methyl]benzamidine Formula: C14H13N3O3S MolecularWeight: 303.33632

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=CC=C(C=C2)[N+](=O)[O-])C(=NO)N

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=CC=C(C=C2)[N+](=O)[O-])/C(=N/O)/N

InChI

InChI=1S/C14H13N3O3S/c15-14(16-18)13-4-2-1-3-10(13)9-21-12-7-5-11(6-8-12)17(19)20/h1-8,18H,9H2,(H2,15,16)