5-butylsulfanyl-2-chloranyl-4-nitro-aniline

Systemtic Name: 5-butylsulfanyl-2-chloranyl-4-nitro-aniline Openeye Name: 5-butylsulfanyl-2-chloro-4-nitro-aniline CAS Name: 5-(butylthio)-2-chloro-4-nitroaniline IUPAC Name: 5-butylsulfanyl-2-chloro-4-nitroaniline Traditional Name: [5-(butylthio)-2-chloro-4-nitro-phenyl]amine Formula: C10H13ClN2O2S MolecularWeight: 260.74042

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=C(C=C(C(=C1)N)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCCSC1=C(C=C(C(=C1)N)Cl)[N+](=O)[O-]

InChI

InChI=1S/C10H13ClN2O2S/c1-2-3-4-16-10-6-8(12)7(11)5-9(10)13(14)15/h5-6H,2-4,12H2,1H3