4-[1-(1-ethyl-2-oxidanyl-4-oxidanylidene-quinolin-3-yl)ethylamino]-5-methyl-naphthalene-2,7-disulfonic acid

Systemtic Name: 4-[1-(1-ethyl-2-oxidanyl-4-oxidanylidene-quinolin-3-yl)ethylamino]-5-methyl-naphthalene-2,7-disulfonic acid Openeye Name: 4-[1-(1-ethyl-2-hydroxy-4-oxo-3-quinolyl)ethylamino]-5-methyl-naphthalene-2,7-disulfonic acid CAS Name: 4-[1-(1-ethyl-2-hydroxy-4-oxo-3-quinolinyl)ethylamino]-5-methylnaphthalene-2,7-disulfonic acid IUPAC Name: 4-[1-(1-ethyl-2-hydroxy-4-oxoquinolin-3-yl)ethylamino]-5-methylnaphthalene-2,7-disulfonic acid Traditional Name: 4-[1-(1-ethyl-2-hydroxy-4-keto-3-quinolyl)ethylamino]-5-methyl-naphthalene-2,7-disulfonic acid Formula: C24H24N2O8S2 MolecularWeight: 532.58596

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C(=O)C(=C1O)C(C)NC3=CC(=CC4=CC(=CC(=C43)C)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CCN1C2=CC=CC=C2C(=O)C(=C1O)C(C)NC3=CC(=CC4=CC(=CC(=C43)C)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C24H24N2O8S2/c1-4-26-20-8-6-5-7-18(20)23(27)22(24(26)28)14(3)25-19-12-17(36(32,33)34)11-15-10-16(35(29,30)31)9-13(2)21(15)19/h5-12,14,25,28H,4H2,1-3H3,(H,29,30,31)(H,32,33,34)