4-(1,2,3-triazin-4-ylamino)naphthalene-1,5-disulfonic acid

Systemtic Name: 4-(1,2,3-triazin-4-ylamino)naphthalene-1,5-disulfonic acid Openeye Name: 4-(triazin-4-ylamino)naphthalene-1,5-disulfonic acid CAS Name: 4-(4-triazinylamino)naphthalene-1,5-disulfonic acid IUPAC Name: 4-(triazin-4-ylamino)naphthalene-1,5-disulfonic acid Traditional Name: 4-(triazin-4-ylamino)naphthalene-1,5-disulfonic acid Formula: C13H10N4O6S2 MolecularWeight: 382.3717

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2C(=C1)S(=O)(=O)O)NC3=NN=NC=C3)S(=O)(=O)O

Isomeric SMILES

C1=CC2=C(C=CC(=C2C(=C1)S(=O)(=O)O)NC3=NN=NC=C3)S(=O)(=O)O

InChI

InChI=1S/C13H10N4O6S2/c18-24(19,20)10-5-4-9(15-12-6-7-14-17-16-12)13-8(10)2-1-3-11(13)25(21,22)23/h1-7H,(H,14,15,16)(H,18,19,20)(H,21,22,23)