1-(3-methylbutylsulfanyl)-4-(3-nitropropyl)benzene

Systemtic Name: 1-(3-methylbutylsulfanyl)-4-(3-nitropropyl)benzene Openeye Name: 1-isopentylsulfanyl-4-(3-nitropropyl)benzene CAS Name: 1-(3-methylbutylthio)-4-(3-nitropropyl)benzene IUPAC Name: 1-(3-methylbutylsulfanyl)-4-(3-nitropropyl)benzene Traditional Name: 1-(isoamylthio)-4-(3-nitropropyl)benzene Formula: C14H21NO2S MolecularWeight: 267.38704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=CC=C(C=C1)CCC[N+](=O)[O-]

Isomeric SMILES

CC(C)CCSC1=CC=C(C=C1)CCC[N+](=O)[O-]

InChI

InChI=1S/C14H21NO2S/c1-12(2)9-11-18-14-7-5-13(6-8-14)4-3-10-15(16)17/h5-8,12H,3-4,9-11H2,1-2H3