2-chloranyl-4-nitro-6-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]phenolate

Systemtic Name: 2-chloranyl-4-nitro-6-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]phenolate Openeye Name: 2-chloro-4-nitro-6-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]phenolate CAS Name: 2-chloro-4-nitro-6-[[[[(E)-1-oxo-3-phenylprop-2-enyl]amino]-sulfanylidenemethyl]amino]phenolate IUPAC Name: 2-chloro-4-nitro-6-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]phenolate Traditional Name: 2-chloro-4-nitro-6-[[(E)-3-phenylacryloyl]thiocarbamoylamino]phenolate Formula: C16H11ClN3O4S- MolecularWeight: 376.79424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)NC(=S)NC2=CC(=CC(=C2[O-])Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C(=O)NC(=S)NC2=CC(=CC(=C2[O-])Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H12ClN3O4S/c17-12-8-11(20(23)24)9-13(15(12)22)18-16(25)19-14(21)7-6-10-4-2-1-3-5-10/h1-9,22H,(H2,18,19,21,25)/p-1/b7-6+