2-(2-anthracen-9-ylsulfanylethyl)-3-methoxy-4-oxidanyl-4-(3-phenylprop-1-ynyl)cyclobut-2-en-1-one

Systemtic Name: 2-(2-anthracen-9-ylsulfanylethyl)-3-methoxy-4-oxidanyl-4-(3-phenylprop-1-ynyl)cyclobut-2-en-1-one Openeye Name: 2-[2-(9-anthrylsulfanyl)ethyl]-4-hydroxy-3-methoxy-4-(3-phenylprop-1-ynyl)cyclobut-2-en-1-one CAS Name: 2-[2-(9-anthracenylthio)ethyl]-4-hydroxy-3-methoxy-4-(3-phenylprop-1-ynyl)-1-cyclobut-2-enone IUPAC Name: 2-(2-anthracen-9-ylsulfanylethyl)-4-hydroxy-3-methoxy-4-(3-phenylprop-1-ynyl)cyclobut-2-en-1-one Traditional Name: 2-[2-(9-anthrylthio)ethyl]-4-hydroxy-3-methoxy-4-(3-phenylprop-1-ynyl)cyclobut-2-en-1-one Formula: C30H24O3S MolecularWeight: 464.57476

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=O)C1(C#CCC2=CC=CC=C2)O)CCSC3=C4C=CC=CC4=CC5=CC=CC=C53

Isomeric SMILES

COC1=C(C(=O)C1(C#CCC2=CC=CC=C2)O)CCSC3=C4C=CC=CC4=CC5=CC=CC=C53

InChI

InChI=1S/C30H24O3S/c1-33-29-26(28(31)30(29,32)18-9-12-21-10-3-2-4-11-21)17-19-34-27-24-15-7-5-13-22(24)20-23-14-6-8-16-25(23)27/h2-8,10-11,13-16,20,32H,12,17,19H2,1H3