dipotassium 2-[[(2-methoxy-4-nitro-phenyl)amino]-(propan-2-ylamino)amino]-5-sulfonato-benzoate

Systemtic Name: dipotassium 2-[[(2-methoxy-4-nitro-phenyl)amino]-(propan-2-ylamino)amino]-5-sulfonato-benzoate Openeye Name: dipotassium 2-[(isopropylamino)-(2-methoxy-4-nitro-anilino)amino]-5-sulfonato-benzoate CAS Name: dipotassium 2-[(2-methoxy-4-nitroanilino)-(propan-2-ylamino)amino]-5-sulfonatobenzoate IUPAC Name: dipotassium 2-[(2-methoxy-4-nitroanilino)-(propan-2-ylamino)amino]-5-sulfonatobenzoate Traditional Name: dipotassium 2-[(isopropylamino)-(2-methoxy-4-nitro-anilino)amino]-5-sulfonato-benzoate Formula: C17H18K2N4O8S MolecularWeight: 516.60842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NN(C1=C(C=C(C=C1)S(=O)(=O)[O-])C(=O)[O-])NC2=C(C=C(C=C2)[N+](=O)[O-])OC.[K+].[K+]

Isomeric SMILES

CC(C)NN(C1=C(C=C(C=C1)S(=O)(=O)[O-])C(=O)[O-])NC2=C(C=C(C=C2)[N+](=O)[O-])OC.[K+].[K+]

InChI

InChI=1S/C17H20N4O8S.2K/c1-10(2)18-20(19-14-6-4-11(21(24)25)8-16(14)29-3)15-7-5-12(30(26,27)28)9-13(15)17(22)23;;/h4-10,18-19H,1-3H3,(H,22,23)(H,26,27,28);;/q;2*+1/p-2