2-[4-[(E)-3-(4-chloranyl-3-nitro-phenyl)-3-oxidanylidene-prop-1-enyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[(E)-3-(4-chloranyl-3-nitro-phenyl)-3-oxidanylidene-prop-1-enyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[(E)-3-(4-chloro-3-nitro-phenyl)-3-oxo-prop-1-enyl]phenoxy]acetic acid CAS Name: 2-[4-[(E)-3-(4-chloro-3-nitrophenyl)-3-oxoprop-1-enyl]phenoxy]acetic acid IUPAC Name: 2-[4-[(E)-3-(4-chloro-3-nitrophenyl)-3-oxoprop-1-enyl]phenoxy]acetic acid Traditional Name: 2-[4-[(E)-3-(4-chloro-3-nitro-phenyl)-3-keto-prop-1-enyl]phenoxy]acetic acid Formula: C17H12ClNO6 MolecularWeight: 361.73328

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12ClNO6/c18-14-7-4-12(9-15(14)19(23)24)16(20)8-3-11-1-5-13(6-2-11)25-10-17(21)22/h1-9H,10H2,(H,21,22)/b8-3+