4-[[(E)-3-(4-chloranyl-3-nitro-phenyl)prop-2-enoyl]amino]-2-oxidanyl-benzoate

Systemtic Name: 4-[[(E)-3-(4-chloranyl-3-nitro-phenyl)prop-2-enoyl]amino]-2-oxidanyl-benzoate Openeye Name: 4-[[(E)-3-(4-chloro-3-nitro-phenyl)prop-2-enoyl]amino]-2-hydroxy-benzoate CAS Name: 4-[[(E)-3-(4-chloro-3-nitrophenyl)-1-oxoprop-2-enyl]amino]-2-hydroxybenzoate IUPAC Name: 4-[[(E)-3-(4-chloro-3-nitrophenyl)prop-2-enoyl]amino]-2-hydroxybenzoate Traditional Name: 4-[[(E)-3-(4-chloro-3-nitro-phenyl)acryloyl]amino]-2-hydroxy-benzoate Formula: C16H10ClN2O6- MolecularWeight: 361.7134

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=CC(=O)NC2=CC(=C(C=C2)C(=O)[O-])O)[N+](=O)[O-])Cl

Isomeric SMILES

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

InChI

InChI=1S/C16H11ClN2O6/c17-12-5-1-9(7-13(12)19(24)25)2-6-15(21)18-10-3-4-11(16(22)23)14(20)8-10/h1-8,20H,(H,18,21)(H,22,23)/p-1/b6-2+