2-[6-[4-(1-adamantylsulfanyl)phenyl]naphthalen-2-yl]cyclohexane-1,3-dione

Systemtic Name: 2-[6-[4-(1-adamantylsulfanyl)phenyl]naphthalen-2-yl]cyclohexane-1,3-dione Openeye Name: 2-[6-[4-(1-adamantylsulfanyl)phenyl]-2-naphthyl]cyclohexane-1,3-dione CAS Name: 2-[6-[4-(1-adamantylthio)phenyl]-2-naphthalenyl]cyclohexane-1,3-dione IUPAC Name: 2-[6-[4-(1-adamantylsulfanyl)phenyl]naphthalen-2-yl]cyclohexane-1,3-dione Traditional Name: 2-[6-[4-(1-adamantylthio)phenyl]-2-naphthyl]cyclohexane-1,3-quinone Formula: C32H32O2S MolecularWeight: 480.66028

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C(C(=O)C1)C2=CC3=C(C=C2)C=C(C=C3)C4=CC=C(C=C4)SC56CC7CC(C5)CC(C7)C6

Isomeric SMILES

C1CC(=O)C(C(=O)C1)C2=CC3=C(C=C2)C=C(C=C3)C4=CC=C(C=C4)SC56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C32H32O2S/c33-29-2-1-3-30(34)31(29)27-7-6-25-15-24(4-5-26(25)16-27)23-8-10-28(11-9-23)35-32-17-20-12-21(18-32)14-22(13-20)19-32/h4-11,15-16,20-22,31H,1-3,12-14,17-19H2