11-naphthalen-2-ylsulfonylundeca-2,9-diynyl anthracene-1-carboxylate

Systemtic Name: 11-naphthalen-2-ylsulfonylundeca-2,9-diynyl anthracene-1-carboxylate Openeye Name: 11-(2-naphthylsulfonyl)undeca-2,9-diynyl anthracene-1-carboxylate CAS Name: 1-anthracenecarboxylic acid 11-(2-naphthalenylsulfonyl)undeca-2,9-diynyl ester IUPAC Name: 11-naphthalen-2-ylsulfonylundeca-2,9-diynyl anthracene-1-carboxylate Traditional Name: anthracene-1-carboxylic acid 11-(2-naphthylsulfonyl)undeca-2,9-diynyl ester Formula: C36H30O4S MolecularWeight: 558.686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)CC#CCCCCCC#CCOC(=O)C3=CC=CC4=CC5=CC=CC=C5C=C43

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)CC#CCCCCCC#CCOC(=O)C3=CC=CC4=CC5=CC=CC=C5C=C43

InChI

InChI=1S/C36H30O4S/c37-36(34-20-14-19-32-25-29-16-10-11-18-31(29)27-35(32)34)40-23-12-6-4-2-1-3-5-7-13-24-41(38,39)33-22-21-28-15-8-9-17-30(28)26-33/h8-11,14-22,25-27H,1-5,23-24H2