3-[4-(3-nitrophenyl)phenyl]sulfanylpropan-1-amine

Systemtic Name: 3-[4-(3-nitrophenyl)phenyl]sulfanylpropan-1-amine Openeye Name: 3-[4-(3-nitrophenyl)phenyl]sulfanylpropan-1-amine CAS Name: 3-[[4-(3-nitrophenyl)phenyl]thio]-1-propanamine IUPAC Name: 3-[4-(3-nitrophenyl)phenyl]sulfanylpropan-1-amine Traditional Name: 3-[[4-(3-nitrophenyl)phenyl]thio]propylamine Formula: C15H16N2O2S MolecularWeight: 288.36474

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16N2O2S/c16-9-2-10-20-15-7-5-12(6-8-15)13-3-1-4-14(11-13)17(18)19/h1,3-8,11H,2,9-10,16H2