3-azanyl-7-(pyridin-2-ylcarbonylamino)naphthalene-1,5-disulfonic acid

Systemtic Name: 3-azanyl-7-(pyridin-2-ylcarbonylamino)naphthalene-1,5-disulfonic acid Openeye Name: 3-amino-7-(pyridine-2-carbonylamino)naphthalene-1,5-disulfonic acid CAS Name: 3-amino-7-[[oxo(2-pyridinyl)methyl]amino]naphthalene-1,5-disulfonic acid IUPAC Name: 3-amino-7-(pyridine-2-carbonylamino)naphthalene-1,5-disulfonic acid Traditional Name: 3-amino-7-picolinamido-naphthalene-1,5-disulfonic acid Formula: C16H13N3O7S2 MolecularWeight: 423.42032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C(=O)NC2=CC3=C(C=C(C=C3C(=C2)S(=O)(=O)O)N)S(=O)(=O)O

Isomeric SMILES

C1=CC=NC(=C1)C(=O)NC2=CC3=C(C=C(C=C3C(=C2)S(=O)(=O)O)N)S(=O)(=O)O

InChI

InChI=1S/C16H13N3O7S2/c17-9-5-11-12(14(6-9)27(21,22)23)7-10(8-15(11)28(24,25)26)19-16(20)13-3-1-2-4-18-13/h1-8H,17H2,(H,19,20)(H,21,22,23)(H,24,25,26)