7-[[4,6-bis(2-hydroxyethylamino)-1,3,5-triazin-2-yl]amino]-4-oxidanyl-naphthalene-2-sulfonic acid

Systemtic Name: 7-[[4,6-bis(2-hydroxyethylamino)-1,3,5-triazin-2-yl]amino]-4-oxidanyl-naphthalene-2-sulfonic acid Openeye Name: 7-[[4,6-bis(2-hydroxyethylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-naphthalene-2-sulfonic acid CAS Name: 7-[[4,6-bis(2-hydroxyethylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-2-naphthalenesulfonic acid IUPAC Name: 7-[[4,6-bis(2-hydroxyethylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxynaphthalene-2-sulfonic acid Traditional Name: 7-[[4,6-bis(2-hydroxyethylamino)-s-triazin-2-yl]amino]-4-hydroxy-naphthalene-2-sulfonic acid Formula: C17H20N6O6S MolecularWeight: 436.4423

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C(C=C2C=C1NC3=NC(=NC(=N3)NCCO)NCCO)S(=O)(=O)O)O

Isomeric SMILES

C1=CC2=C(C=C(C=C2C=C1NC3=NC(=NC(=N3)NCCO)NCCO)S(=O)(=O)O)O

InChI

InChI=1S/C17H20N6O6S/c24-5-3-18-15-21-16(19-4-6-25)23-17(22-15)20-11-1-2-13-10(7-11)8-12(9-14(13)26)30(27,28)29/h1-2,7-9,24-26H,3-6H2,(H,27,28,29)(H3,18,19,20,21,22,23)