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4-[(E)-2-(5-nitroquinolin-2-yl)ethenyl]benzoic acid

4-[(E)-2-(5-nitroquinolin-2-yl)ethenyl]benzoic acid

Systemtic Name:4-[(E)-2-(5-nitroquinolin-2-yl)ethenyl]benzoic acid
Openeye Name:4-[(E)-2-(5-nitro-2-quinolyl)vinyl]benzoic acid
CAS Name:4-[(E)-2-(5-nitro-2-quinolinyl)ethenyl]benzoic acid
IUPAC Name:4-[(E)-2-(5-nitroquinolin-2-yl)ethenyl]benzoic acid
Traditional Name:4-[(E)-2-(5-nitro-2-quinolyl)vinyl]benzoic acid
Formula: C18H12N2O4
MolecularWeight: 320.29888
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=N2)C=CC3=CC=C(C=C3)C(=O)O)C(=C1)[N+](=O)[O-]


Isomeric SMILES

C1=CC2=C(C=CC(=N2)/C=C/C3=CC=C(C=C3)C(=O)O)C(=C1)[N+](=O)[O-]


InChI

InChI=1S/C18H12N2O4/c21-18(22)13-7-4-12(5-8-13)6-9-14-10-11-15-16(19-14)2-1-3-17(15)20(23)24/h1-11H,(H,21,22)/b9-6+


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