1-nitro-4-(1-phenylethylsulfanyl)benzene

Systemtic Name: 1-nitro-4-(1-phenylethylsulfanyl)benzene Openeye Name: 1-nitro-4-(1-phenylethylsulfanyl)benzene CAS Name: 1-nitro-4-(1-phenylethylthio)benzene IUPAC Name: 1-nitro-4-(1-phenylethylsulfanyl)benzene Traditional Name: 1-nitro-4-(1-phenylethylthio)benzene Formula: C14H13NO2S MolecularWeight: 259.32352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC=CC=C1)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H13NO2S/c1-11(12-5-3-2-4-6-12)18-14-9-7-13(8-10-14)15(16)17/h2-11H,1H3