2,7-bis(azepan-1-ylsulfonyl)anthracene-9,10-dione

Systemtic Name: 2,7-bis(azepan-1-ylsulfonyl)anthracene-9,10-dione Openeye Name: 2,7-bis(azepan-1-ylsulfonyl)anthracene-9,10-dione CAS Name: 2,7-bis(1-azepanylsulfonyl)anthracene-9,10-dione IUPAC Name: 2,7-bis(azepan-1-ylsulfonyl)anthracene-9,10-dione Traditional Name: 2,7-bis(azepan-1-ylsulfonyl)-9,10-anthraquinone Formula: C26H30N2O6S2 MolecularWeight: 530.6562

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)C(=O)C4=C(C3=O)C=C(C=C4)S(=O)(=O)N5CCCCCC5

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)C(=O)C4=C(C3=O)C=C(C=C4)S(=O)(=O)N5CCCCCC5

InChI

InChI=1S/C26H30N2O6S2/c29-25-21-11-9-19(35(31,32)27-13-5-1-2-6-14-27)17-23(21)26(30)24-18-20(10-12-22(24)25)36(33,34)28-15-7-3-4-8-16-28/h9-12,17-18H,1-8,13-16H2