2-(4-nitrophenyl)sulfanyl-4-propyl-cyclohexane-1-carbonitrile

Systemtic Name: 2-(4-nitrophenyl)sulfanyl-4-propyl-cyclohexane-1-carbonitrile Openeye Name: 2-(4-nitrophenyl)sulfanyl-4-propyl-cyclohexanecarbonitrile CAS Name: 2-[(4-nitrophenyl)thio]-4-propyl-1-cyclohexanecarbonitrile IUPAC Name: 2-(4-nitrophenyl)sulfanyl-4-propylcyclohexane-1-carbonitrile Traditional Name: 2-[(4-nitrophenyl)thio]-4-propyl-cyclohexanecarbonitrile Formula: C16H20N2O2S MolecularWeight: 304.4072

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC(C(C1)SC2=CC=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

CCCC1CCC(C(C1)SC2=CC=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C16H20N2O2S/c1-2-3-12-4-5-13(11-17)16(10-12)21-15-8-6-14(7-9-15)18(19)20/h6-9,12-13,16H,2-5,10H2,1H3