9-(phenylsulfonyl)nona-2,7-diynyl 9,10-bis(oxidanylidene)anthracene-2-carboxylate

Systemtic Name: 9-(phenylsulfonyl)nona-2,7-diynyl 9,10-bis(oxidanylidene)anthracene-2-carboxylate Openeye Name: 9-(benzenesulfonyl)nona-2,7-diynyl 9,10-dioxoanthracene-2-carboxylate CAS Name: 9,10-dioxo-2-anthracenecarboxylic acid 9-(benzenesulfonyl)nona-2,7-diynyl ester IUPAC Name: 9-(benzenesulfonyl)nona-2,7-diynyl 9,10-dioxoanthracene-2-carboxylate Traditional Name: 9,10-diketoanthracene-2-carboxylic acid 9-besylnona-2,7-diynyl ester Formula: C30H22O6S MolecularWeight: 510.55708

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CC#CCCCC#CCOC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CC#CCCCC#CCOC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C30H22O6S/c31-28-24-15-9-10-16-25(24)29(32)27-21-22(17-18-26(27)28)30(33)36-19-11-4-2-1-3-5-12-20-37(34,35)23-13-7-6-8-14-23/h6-10,13-18,21H,1-3,19-20H2