2-methylsulfanyl-N-[1-(3-nitrophenyl)propyl]aniline

Systemtic Name: 2-methylsulfanyl-N-[1-(3-nitrophenyl)propyl]aniline Openeye Name: 2-methylsulfanyl-N-[1-(3-nitrophenyl)propyl]aniline CAS Name: 2-(methylthio)-N-[1-(3-nitrophenyl)propyl]aniline IUPAC Name: 2-methylsulfanyl-N-[1-(3-nitrophenyl)propyl]aniline Traditional Name: [2-(methylthio)phenyl]-[1-(3-nitrophenyl)propyl]amine Formula: C16H18N2O2S MolecularWeight: 302.39132

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=CC=C1)[N+](=O)[O-])NC2=CC=CC=C2SC

Isomeric SMILES

CCC(C1=CC(=CC=C1)[N+](=O)[O-])NC2=CC=CC=C2SC

InChI

InChI=1S/C16H18N2O2S/c1-3-14(12-7-6-8-13(11-12)18(19)20)17-15-9-4-5-10-16(15)21-2/h4-11,14,17H,3H2,1-2H3