1-(4-cyclohexylsulfanylphenyl)azepane-2,7-dione

Systemtic Name: 1-(4-cyclohexylsulfanylphenyl)azepane-2,7-dione Openeye Name: 1-(4-cyclohexylsulfanylphenyl)azepane-2,7-dione CAS Name: 1-[4-(cyclohexylthio)phenyl]azepane-2,7-dione IUPAC Name: 1-(4-cyclohexylsulfanylphenyl)azepane-2,7-dione Traditional Name: 1-[4-(cyclohexylthio)phenyl]azepane-2,7-quinone Formula: C18H23NO2S MolecularWeight: 317.44572

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SC2=CC=C(C=C2)N3C(=O)CCCCC3=O

Isomeric SMILES

C1CCC(CC1)SC2=CC=C(C=C2)N3C(=O)CCCCC3=O

InChI

InChI=1S/C18H23NO2S/c20-17-8-4-5-9-18(21)19(17)14-10-12-16(13-11-14)22-15-6-2-1-3-7-15/h10-13,15H,1-9H2