2-[[[(E)-2-benzamido-3-thiophen-2-yl-prop-2-enoyl]hydrazinylidene]methyl]-4,6-dinitro-phenolate

Systemtic Name: 2-[[[(E)-2-benzamido-3-thiophen-2-yl-prop-2-enoyl]hydrazinylidene]methyl]-4,6-dinitro-phenolate Openeye Name: 2-[[[(E)-2-benzamido-3-(2-thienyl)prop-2-enoyl]hydrazono]methyl]-4,6-dinitro-phenolate CAS Name: 2-[[[(E)-2-benzamido-1-oxo-3-thiophen-2-ylprop-2-enyl]hydrazinylidene]methyl]-4,6-dinitrophenolate IUPAC Name: 2-[[[(E)-2-benzamido-3-thiophen-2-ylprop-2-enoyl]hydrazinylidene]methyl]-4,6-dinitrophenolate Traditional Name: 2-[[[(E)-2-benzamido-3-(2-thienyl)acryloyl]hydrazono]methyl]-4,6-dinitro-phenolate Formula: C21H14N5O7S- MolecularWeight: 480.43016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(=CC2=CC=CS2)C(=O)NN=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N/C(=C/C2=CC=CS2)/C(=O)NN=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H15N5O7S/c27-19-14(9-15(25(30)31)10-18(19)26(32)33)12-22-24-21(29)17(11-16-7-4-8-34-16)23-20(28)13-5-2-1-3-6-13/h1-12,27H,(H,23,28)(H,24,29)/p-1/b17-11+,22-12?