2-[(E)-[[(2R)-2-(4-bromanylphenoxy)propanoyl]hydrazinylidene]methyl]-4-nitro-phenolate

Systemtic Name: 2-[(E)-[[(2R)-2-(4-bromanylphenoxy)propanoyl]hydrazinylidene]methyl]-4-nitro-phenolate Openeye Name: 2-[(E)-[[(2R)-2-(4-bromophenoxy)propanoyl]hydrazono]methyl]-4-nitro-phenolate CAS Name: 2-[(E)-[[(2R)-2-(4-bromophenoxy)-1-oxopropyl]hydrazinylidene]methyl]-4-nitrophenolate IUPAC Name: 2-[(E)-[[(2R)-2-(4-bromophenoxy)propanoyl]hydrazinylidene]methyl]-4-nitrophenolate Traditional Name: 2-[(E)-[[(2R)-2-(4-bromophenoxy)propanoyl]hydrazono]methyl]-4-nitro-phenolate Formula: C16H13BrN3O5- MolecularWeight: 407.19552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NN=CC1=C(C=CC(=C1)[N+](=O)[O-])[O-])OC2=CC=C(C=C2)Br

Isomeric SMILES

C[C@H](C(=O)N/N=C/C1=C(C=CC(=C1)[N+](=O)[O-])[O-])OC2=CC=C(C=C2)Br

InChI

InChI=1S/C16H14BrN3O5/c1-10(25-14-5-2-12(17)3-6-14)16(22)19-18-9-11-8-13(20(23)24)4-7-15(11)21/h2-10,21H,1H3,(H,19,22)/p-1/b18-9+/t10-/m1/s1