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4-[(3-nitrophenyl)methyl]benzoic acid

4-[(3-nitrophenyl)methyl]benzoic acid

Systemtic Name:4-[(3-nitrophenyl)methyl]benzoic acid
Openeye Name:4-[(3-nitrophenyl)methyl]benzoic acid
CAS Name:4-[(3-nitrophenyl)methyl]benzoic acid
IUPAC Name:4-[(3-nitrophenyl)methyl]benzoic acid
Traditional Name:4-(3-nitrobenzyl)benzoic acid
Formula: C14H11NO4
MolecularWeight: 257.24144
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C14H11NO4/c16-14(17)12-6-4-10(5-7-12)8-11-2-1-3-13(9-11)15(18)19/h1-7,9H,8H2,(H,16,17)


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