1-azanyl-4-[[4-(dimethylamino)cyclohexyl]amino]-9,10-bis(oxidanylidene)anthracene-2-sulfonic acid

Systemtic Name: 1-azanyl-4-[[4-(dimethylamino)cyclohexyl]amino]-9,10-bis(oxidanylidene)anthracene-2-sulfonic acid Openeye Name: 1-amino-4-[[4-(dimethylamino)cyclohexyl]amino]-9,10-dioxo-anthracene-2-sulfonic acid CAS Name: 1-amino-4-[[4-(dimethylamino)cyclohexyl]amino]-9,10-dioxo-2-anthracenesulfonic acid IUPAC Name: 1-amino-4-[[4-(dimethylamino)cyclohexyl]amino]-9,10-dioxoanthracene-2-sulfonic acid Traditional Name: 1-amino-4-[[4-(dimethylamino)cyclohexyl]amino]-9,10-diketo-anthracene-2-sulfonic acid Formula: C22H25N3O5S MolecularWeight: 443.516

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CCC(CC1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O

Isomeric SMILES

CN(C)C1CCC(CC1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O

InChI

InChI=1S/C22H25N3O5S/c1-25(2)13-9-7-12(8-10-13)24-16-11-17(31(28,29)30)20(23)19-18(16)21(26)14-5-3-4-6-15(14)22(19)27/h3-6,11-13,24H,7-10,23H2,1-2H3,(H,28,29,30)