[4-[(4-nitrophenyl)methyl]phenyl]methanesulfonic acid

Systemtic Name: [4-[(4-nitrophenyl)methyl]phenyl]methanesulfonic acid Openeye Name: [4-[(4-nitrophenyl)methyl]phenyl]methanesulfonic acid CAS Name: [4-[(4-nitrophenyl)methyl]phenyl]methanesulfonic acid IUPAC Name: [4-[(4-nitrophenyl)methyl]phenyl]methanesulfonic acid Traditional Name: [4-(4-nitrobenzyl)phenyl]methanesulfonic acid Formula: C14H13NO5S MolecularWeight: 307.32172

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=CC=C(C=C2)[N+](=O)[O-])CS(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1CC2=CC=C(C=C2)[N+](=O)[O-])CS(=O)(=O)O

InChI

InChI=1S/C14H13NO5S/c16-15(17)14-7-5-12(6-8-14)9-11-1-3-13(4-2-11)10-21(18,19)20/h1-8H,9-10H2,(H,18,19,20)