4-[8-(2-bromophenyl)iminoxanthen-1-yl]benzene-1,3-disulfonic acid

Systemtic Name: 4-[8-(2-bromophenyl)iminoxanthen-1-yl]benzene-1,3-disulfonic acid Openeye Name: 4-[8-(2-bromophenyl)iminoxanthen-1-yl]benzene-1,3-disulfonic acid CAS Name: 4-[8-(2-bromophenyl)imino-1-xanthenyl]benzene-1,3-disulfonic acid IUPAC Name: 4-[8-(2-bromophenyl)iminoxanthen-1-yl]benzene-1,3-disulfonic acid Traditional Name: 4-[8-(2-bromophenyl)iminoxanthen-1-yl]benzene-1,3-disulfonic acid Formula: C25H16BrNO7S2 MolecularWeight: 586.43104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N=C2C=CC=C3C2=CC4=C(C=CC=C4O3)C5=C(C=C(C=C5)S(=O)(=O)O)S(=O)(=O)O)Br

Isomeric SMILES

C1=CC=C(C(=C1)N=C2C=CC=C3C2=CC4=C(C=CC=C4O3)C5=C(C=C(C=C5)S(=O)(=O)O)S(=O)(=O)O)Br

InChI

InChI=1S/C25H16BrNO7S2/c26-20-6-1-2-7-22(20)27-21-8-4-10-24-19(21)14-18-16(5-3-9-23(18)34-24)17-12-11-15(35(28,29)30)13-25(17)36(31,32)33/h1-14H,(H,28,29,30)(H,31,32,33)