2-(4-azanyl-5-methoxy-2-methyl-phenyl)benzene-1,4-disulfonic acid

Systemtic Name: 2-(4-azanyl-5-methoxy-2-methyl-phenyl)benzene-1,4-disulfonic acid Openeye Name: 2-(4-amino-5-methoxy-2-methyl-phenyl)benzene-1,4-disulfonic acid CAS Name: 2-(4-amino-5-methoxy-2-methylphenyl)benzene-1,4-disulfonic acid IUPAC Name: 2-(4-amino-5-methoxy-2-methylphenyl)benzene-1,4-disulfonic acid Traditional Name: 2-(4-amino-5-methoxy-2-methyl-phenyl)benzene-1,4-disulfonic acid Formula: C14H15NO7S2 MolecularWeight: 373.4014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2=C(C=CC(=C2)S(=O)(=O)O)S(=O)(=O)O)OC)N

Isomeric SMILES

CC1=CC(=C(C=C1C2=C(C=CC(=C2)S(=O)(=O)O)S(=O)(=O)O)OC)N

InChI

InChI=1S/C14H15NO7S2/c1-8-5-12(15)13(22-2)7-10(8)11-6-9(23(16,17)18)3-4-14(11)24(19,20)21/h3-7H,15H2,1-2H3,(H,16,17,18)(H,19,20,21)