diethyl 1,3-diphenylbenzo[f][2]benzothiole-6,7-dicarboxylate

Systemtic Name: diethyl 1,3-diphenylbenzo[f][2]benzothiole-6,7-dicarboxylate Openeye Name: diethyl 1,3-diphenylbenzo[f][2]benzothiole-6,7-dicarboxylate CAS Name: 1,3-diphenylbenzo[f][2]benzothiole-6,7-dicarboxylic acid diethyl ester IUPAC Name: diethyl 1,3-diphenylbenzo[f][2]benzothiole-6,7-dicarboxylate Traditional Name: 1,3-diphenylbenz[f]isobenzothiophene-6,7-dicarboxylic acid diethyl ester Formula: C30H24O4S MolecularWeight: 480.57416

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=CC3=C(SC(=C3C=C2C=C1C(=O)OCC)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=CC2=CC3=C(SC(=C3C=C2C=C1C(=O)OCC)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H24O4S/c1-3-33-29(31)25-17-21-15-23-24(16-22(21)18-26(25)30(32)34-4-2)28(20-13-9-6-10-14-20)35-27(23)19-11-7-5-8-12-19/h5-18H,3-4H2,1-2H3