1-azanyl-4-(cyclohexylamino)-9,10-bis(oxidanylidene)anthracene-2,3-disulfonic acid

Systemtic Name: 1-azanyl-4-(cyclohexylamino)-9,10-bis(oxidanylidene)anthracene-2,3-disulfonic acid Openeye Name: 1-amino-4-(cyclohexylamino)-9,10-dioxo-anthracene-2,3-disulfonic acid CAS Name: 1-amino-4-(cyclohexylamino)-9,10-dioxoanthracene-2,3-disulfonic acid IUPAC Name: 1-amino-4-(cyclohexylamino)-9,10-dioxoanthracene-2,3-disulfonic acid Traditional Name: 1-amino-4-(cyclohexylamino)-9,10-diketo-anthracene-2,3-disulfonic acid Formula: C20H20N2O8S2 MolecularWeight: 480.5114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N2O8S2/c21-15-13-14(18(24)12-9-5-4-8-11(12)17(13)23)16(22-10-6-2-1-3-7-10)20(32(28,29)30)19(15)31(25,26)27/h4-5,8-10,22H,1-3,6-7,21H2,(H,25,26,27)(H,28,29,30)