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

Systemtic Name: 4-methylsulfanyl-N-[1-(3-nitrophenyl)propyl]aniline Openeye Name: 4-methylsulfanyl-N-[1-(3-nitrophenyl)propyl]aniline CAS Name: 4-(methylthio)-N-[1-(3-nitrophenyl)propyl]aniline IUPAC Name: 4-methylsulfanyl-N-[1-(3-nitrophenyl)propyl]aniline Traditional Name: [4-(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=C(C=C2)SC

Isomeric SMILES

CCC(C1=CC(=CC=C1)[N+](=O)[O-])NC2=CC=C(C=C2)SC

InChI

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