4-azanyl-3-[(4-iodophenyl)diazenyl]-5-oxidanyl-1,4,4a,8a-tetrahydronaphthalene-1-sulfonic acid

Systemtic Name: 4-azanyl-3-[(4-iodophenyl)diazenyl]-5-oxidanyl-1,4,4a,8a-tetrahydronaphthalene-1-sulfonic acid Openeye Name: 4-amino-5-hydroxy-3-(4-iodophenyl)azo-1,4,4a,8a-tetrahydronaphthalene-1-sulfonic acid CAS Name: 4-amino-5-hydroxy-3-(4-iodophenyl)azo-1,4,4a,8a-tetrahydronaphthalene-1-sulfonic acid IUPAC Name: 4-amino-5-hydroxy-3-[(4-iodophenyl)diazenyl]-1,4,4a,8a-tetrahydronaphthalene-1-sulfonic acid Traditional Name: 4-amino-5-hydroxy-3-(4-iodophenyl)azo-1,4,4a,8a-tetrahydronaphthalene-1-sulfonic acid Formula: C16H16IN3O4S MolecularWeight: 473.28541

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2C(C=C(C(C2C(=C1)O)N)N=NC3=CC=C(C=C3)I)S(=O)(=O)O

Isomeric SMILES

C1=CC2C(C=C(C(C2C(=C1)O)N)N=NC3=CC=C(C=C3)I)S(=O)(=O)O

InChI

InChI=1S/C16H16IN3O4S/c17-9-4-6-10(7-5-9)19-20-12-8-14(25(22,23)24)11-2-1-3-13(21)15(11)16(12)18/h1-8,11,14-16,21H,18H2,(H,22,23,24)