[(5-nitro-2-phenethylsulfanyl-phenyl)-oxidanyl-methyl]phosphonic acid

Systemtic Name: [(5-nitro-2-phenethylsulfanyl-phenyl)-oxidanyl-methyl]phosphonic acid Openeye Name: [hydroxy-(5-nitro-2-phenethylsulfanyl-phenyl)methyl]phosphonic acid CAS Name: [hydroxy-[5-nitro-2-(phenethylthio)phenyl]methyl]phosphonic acid IUPAC Name: [hydroxy-(5-nitro-2-phenethylsulfanylphenyl)methyl]phosphonic acid Traditional Name: [hydroxy-[5-nitro-2-(phenethylthio)phenyl]methyl]phosphonic acid Formula: C15H16NO6PS MolecularWeight: 369.329401

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCSC2=C(C=C(C=C2)[N+](=O)[O-])C(O)P(=O)(O)O

Isomeric SMILES

C1=CC=C(C=C1)CCSC2=C(C=C(C=C2)[N+](=O)[O-])C(O)P(=O)(O)O

InChI

InChI=1S/C15H16NO6PS/c17-15(23(20,21)22)13-10-12(16(18)19)6-7-14(13)24-9-8-11-4-2-1-3-5-11/h1-7,10,15,17H,8-9H2,(H2,20,21,22)