3-[(4-azanyl-2-methoxy-5-methyl-phenyl)diazenyl]naphthalene-1,5-disulfonic acid

Systemtic Name: 3-[(4-azanyl-2-methoxy-5-methyl-phenyl)diazenyl]naphthalene-1,5-disulfonic acid Openeye Name: 3-(4-amino-2-methoxy-5-methyl-phenyl)azonaphthalene-1,5-disulfonic acid CAS Name: 3-(4-amino-2-methoxy-5-methylphenyl)azonaphthalene-1,5-disulfonic acid IUPAC Name: 3-[(4-amino-2-methoxy-5-methylphenyl)diazenyl]naphthalene-1,5-disulfonic acid Traditional Name: 3-(4-amino-2-methoxy-5-methyl-phenyl)azonaphthalene-1,5-disulfonic acid Formula: C18H17N3O7S2 MolecularWeight: 451.47348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1N)OC)N=NC2=CC(=C3C=CC=C(C3=C2)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1N)OC)N=NC2=CC(=C3C=CC=C(C3=C2)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C18H17N3O7S2/c1-10-6-15(16(28-2)9-14(10)19)21-20-11-7-13-12(18(8-11)30(25,26)27)4-3-5-17(13)29(22,23)24/h3-9H,19H2,1-2H3,(H,22,23,24)(H,25,26,27)