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1-azanyl-4-(3-azanyl-2,4,6-trimethyl-5-sulfo-phenyl)-9,10-bis(oxidanylidene)anthracene-2-sulfonic acid

1-azanyl-4-(3-azanyl-2,4,6-trimethyl-5-sulfo-phenyl)-9,10-bis(oxidanylidene)anthracene-2-sulfonic acid

Systemtic Name:1-azanyl-4-(3-azanyl-2,4,6-trimethyl-5-sulfo-phenyl)-9,10-bis(oxidanylidene)anthracene-2-sulfonic acid
Openeye Name:1-amino-4-(3-amino-2,4,6-trimethyl-5-sulfo-phenyl)-9,10-dioxo-anthracene-2-sulfonic acid
CAS Name:1-amino-4-(3-amino-2,4,6-trimethyl-5-sulfophenyl)-9,10-dioxo-2-anthracenesulfonic acid
IUPAC Name:1-amino-4-(3-amino-2,4,6-trimethyl-5-sulfophenyl)-9,10-dioxoanthracene-2-sulfonic acid
Traditional Name:1-amino-4-(3-amino-2,4,6-trimethyl-5-sulfo-phenyl)-9,10-diketo-anthracene-2-sulfonic acid
Formula: C23H20N2O8S2
MolecularWeight: 516.5435
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1N)C)S(=O)(=O)O)C)C2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O


Isomeric SMILES

CC1=C(C(=C(C(=C1N)C)S(=O)(=O)O)C)C2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O


InChI

InChI=1S/C23H20N2O8S2/c1-9-16(10(2)23(35(31,32)33)11(3)19(9)24)14-8-15(34(28,29)30)20(25)18-17(14)21(26)12-6-4-5-7-13(12)22(18)27/h4-8H,24-25H2,1-3H3,(H,28,29,30)(H,31,32,33)


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