2-[(E)-3-(4-aminophenyl)-3-oxidanidyl-prop-2-enoyl]-4-chloranyl-6-nitro-phenolate

Systemtic Name: 2-[(E)-3-(4-aminophenyl)-3-oxidanidyl-prop-2-enoyl]-4-chloranyl-6-nitro-phenolate Openeye Name: 2-[(E)-3-(4-aminophenyl)-3-oxido-prop-2-enoyl]-4-chloro-6-nitro-phenolate CAS Name: 2-[(E)-3-(4-aminophenyl)-3-oxido-1-oxoprop-2-enyl]-4-chloro-6-nitrophenolate IUPAC Name: 2-[(E)-3-(4-aminophenyl)-3-oxidoprop-2-enoyl]-4-chloro-6-nitrophenolate Traditional Name: 2-[(E)-3-(4-aminophenyl)-3-oxido-acryloyl]-4-chloro-6-nitro-phenolate Formula: C15H9ClN2O5-2 MolecularWeight: 332.69536

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=CC(=O)C2=CC(=CC(=C2[O-])[N+](=O)[O-])Cl)[O-])N

Isomeric SMILES

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

InChI

InChI=1S/C15H11ClN2O5/c16-9-5-11(15(21)12(6-9)18(22)23)14(20)7-13(19)8-1-3-10(17)4-2-8/h1-7,19,21H,17H2/p-2/b13-7+