6-anthracen-9-yl-3-(2,6-dimethylphenyl)-8-methyl-4H-1,5,2,3-benzodioxathiazepine

Systemtic Name: 6-anthracen-9-yl-3-(2,6-dimethylphenyl)-8-methyl-4H-1,5,2,3-benzodioxathiazepine Openeye Name: 6-(9-anthryl)-3-(2,6-dimethylphenyl)-8-methyl-4H-1,5,2,3-benzodioxathiazepine CAS Name: 6-(9-anthracenyl)-3-(2,6-dimethylphenyl)-8-methyl-4H-1,5,2,3-benzodioxathiazepine IUPAC Name: 6-anthracen-9-yl-3-(2,6-dimethylphenyl)-8-methyl-4H-1,5,2,3-benzodioxathiazepine Traditional Name: 6-(9-anthryl)-3-(2,6-dimethylphenyl)-8-methyl-4H-1,5,2,3-benzodioxathiazepine Formula: C30H25NO2S MolecularWeight: 463.59

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2COC3=C(C=C(C=C3C4=C5C=CC=CC5=CC6=CC=CC=C64)C)OS2

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2COC3=C(C=C(C=C3C4=C5C=CC=CC5=CC6=CC=CC=C64)C)OS2

InChI

InChI=1S/C30H25NO2S/c1-19-15-26(28-24-13-6-4-11-22(24)17-23-12-5-7-14-25(23)28)30-27(16-19)33-34-31(18-32-30)29-20(2)9-8-10-21(29)3/h4-17H,18H2,1-3H3