2-chloranyl-4-nitro-3-propylsulfanyl-aniline

Systemtic Name: 2-chloranyl-4-nitro-3-propylsulfanyl-aniline Openeye Name: 2-chloro-4-nitro-3-propylsulfanyl-aniline CAS Name: 2-chloro-4-nitro-3-(propylthio)aniline IUPAC Name: 2-chloro-4-nitro-3-propylsulfanylaniline Traditional Name: [2-chloro-4-nitro-3-(propylthio)phenyl]amine Formula: C9H11ClN2O2S MolecularWeight: 246.71384

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C(C=CC(=C1Cl)N)[N+](=O)[O-]

Isomeric SMILES

CCCSC1=C(C=CC(=C1Cl)N)[N+](=O)[O-]

InChI

InChI=1S/C9H11ClN2O2S/c1-2-5-15-9-7(12(13)14)4-3-6(11)8(9)10/h3-4H,2,5,11H2,1H3