2-[(Z)-[2-[(2-bromophenyl)methylsulfanyl]ethanoylhydrazinylidene]methyl]-4-nitro-phenolate

Systemtic Name: 2-[(Z)-[2-[(2-bromophenyl)methylsulfanyl]ethanoylhydrazinylidene]methyl]-4-nitro-phenolate Openeye Name: 2-[(Z)-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]hydrazono]methyl]-4-nitro-phenolate CAS Name: 2-[(Z)-[[2-[(2-bromophenyl)methylthio]-1-oxoethyl]hydrazinylidene]methyl]-4-nitrophenolate IUPAC Name: 2-[(Z)-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]hydrazinylidene]methyl]-4-nitrophenolate Traditional Name: 2-[(Z)-[[2-[(2-bromobenzyl)thio]acetyl]hydrazono]methyl]-4-nitro-phenolate Formula: C16H13BrN3O4S- MolecularWeight: 423.26112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCC(=O)NN=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-])Br

Isomeric SMILES

C1=CC=C(C(=C1)CSCC(=O)N/N=C\C2=C(C=CC(=C2)[N+](=O)[O-])[O-])Br

InChI

InChI=1S/C16H14BrN3O4S/c17-14-4-2-1-3-11(14)9-25-10-16(22)19-18-8-12-7-13(20(23)24)5-6-15(12)21/h1-8,21H,9-10H2,(H,19,22)/p-1/b18-8-