(2-nitrophenyl) 3-[(E)-2-(3,5-dimethyl-4-oxidanyl-phenyl)ethenyl]benzoate

Systemtic Name: (2-nitrophenyl) 3-[(E)-2-(3,5-dimethyl-4-oxidanyl-phenyl)ethenyl]benzoate Openeye Name: (2-nitrophenyl) 3-[(E)-2-(4-hydroxy-3,5-dimethyl-phenyl)vinyl]benzoate CAS Name: 3-[(E)-2-(4-hydroxy-3,5-dimethylphenyl)ethenyl]benzoic acid (2-nitrophenyl) ester IUPAC Name: (2-nitrophenyl) 3-[(E)-2-(4-hydroxy-3,5-dimethylphenyl)ethenyl]benzoate Traditional Name: 3-[(E)-2-(4-hydroxy-3,5-dimethyl-phenyl)vinyl]benzoic acid (2-nitrophenyl) ester Formula: C23H19NO5 MolecularWeight: 389.40066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)C=CC2=CC(=CC=C2)C(=O)OC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1O)C)/C=C/C2=CC(=CC=C2)C(=O)OC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C23H19NO5/c1-15-12-18(13-16(2)22(15)25)11-10-17-6-5-7-19(14-17)23(26)29-21-9-4-3-8-20(21)24(27)28/h3-14,25H,1-2H3/b11-10+