3-[(E)-3-(3-nitrophenyl)prop-1-enyl]benzoate

Systemtic Name: 3-[(E)-3-(3-nitrophenyl)prop-1-enyl]benzoate Openeye Name: 3-[(E)-3-(3-nitrophenyl)prop-1-enyl]benzoate CAS Name: 3-[(E)-3-(3-nitrophenyl)prop-1-enyl]benzoate IUPAC Name: 3-[(E)-3-(3-nitrophenyl)prop-1-enyl]benzoate Traditional Name: 3-[(E)-3-(3-nitrophenyl)prop-1-enyl]benzoate Formula: C16H12NO4- MolecularWeight: 282.27078

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CC=CC2=CC(=CC=C2)C(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C16H13NO4/c18-16(19)14-8-2-6-12(10-14)4-1-5-13-7-3-9-15(11-13)17(20)21/h1-4,6-11H,5H2,(H,18,19)/p-1/b4-1+