[3-bromanyl-2-(phenylsulfanylmethoxy)phenyl]-(4-nitrophenyl)methanol

Systemtic Name: [3-bromanyl-2-(phenylsulfanylmethoxy)phenyl]-(4-nitrophenyl)methanol Openeye Name: [3-bromo-2-(phenylsulfanylmethoxy)phenyl]-(4-nitrophenyl)methanol CAS Name: [3-bromo-2-[(phenylthio)methoxy]phenyl]-(4-nitrophenyl)methanol IUPAC Name: [3-bromo-2-(phenylsulfanylmethoxy)phenyl]-(4-nitrophenyl)methanol Traditional Name: [3-bromo-2-[(phenylthio)methoxy]phenyl]-(4-nitrophenyl)methanol Formula: C20H16BrNO4S MolecularWeight: 446.31434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCOC2=C(C=CC=C2Br)C(C3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)SCOC2=C(C=CC=C2Br)C(C3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C20H16BrNO4S/c21-18-8-4-7-17(19(23)14-9-11-15(12-10-14)22(24)25)20(18)26-13-27-16-5-2-1-3-6-16/h1-12,19,23H,13H2