5-(hydroxymethyl)-4-nitro-2-(phenylsulfanylmethoxy)phenol

Systemtic Name: 5-(hydroxymethyl)-4-nitro-2-(phenylsulfanylmethoxy)phenol Openeye Name: 5-(hydroxymethyl)-4-nitro-2-(phenylsulfanylmethoxy)phenol CAS Name: 5-(hydroxymethyl)-4-nitro-2-[(phenylthio)methoxy]phenol IUPAC Name: 5-(hydroxymethyl)-4-nitro-2-(phenylsulfanylmethoxy)phenol Traditional Name: 5-methylol-4-nitro-2-[(phenylthio)methoxy]phenol Formula: C14H13NO5S MolecularWeight: 307.32172

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCOC2=C(C=C(C(=C2)[N+](=O)[O-])CO)O

Isomeric SMILES

C1=CC=C(C=C1)SCOC2=C(C=C(C(=C2)[N+](=O)[O-])CO)O

InChI

InChI=1S/C14H13NO5S/c16-8-10-6-13(17)14(7-12(10)15(18)19)20-9-21-11-4-2-1-3-5-11/h1-7,16-17H,8-9H2