disodium; 2-ethyl-N-(2-ethylhexyl)hexan-1-amine; (8Z)-7-oxidanylidene-8-[(4-phenyldiazenylphenyl)hydrazinylidene]naphthalene-1,3-disulfonate

Systemtic Name: disodium; 2-ethyl-N-(2-ethylhexyl)hexan-1-amine; (8Z)-7-oxidanylidene-8-[(4-phenyldiazenylphenyl)hydrazinylidene]naphthalene-1,3-disulfonate Openeye Name: disodium; 2-ethyl-N-(2-ethylhexyl)hexan-1-amine; (8Z)-7-oxo-8-[(4-phenylazophenyl)hydrazono]naphthalene-1,3-disulfonate CAS Name: disodium; 2-ethyl-N-(2-ethylhexyl)-1-hexanamine; (8Z)-7-oxo-8-[(4-phenyldiazenylphenyl)hydrazinylidene]naphthalene-1,3-disulfonate IUPAC Name: disodium; 2-ethyl-N-(2-ethylhexyl)hexan-1-amine; (8Z)-7-oxo-8-[(4-phenyldiazenylphenyl)hydrazinylidene]naphthalene-1,3-disulfonate Traditional Name: disodium; bis(2-ethylhexyl)amine; (8Z)-7-keto-8-[(4-phenylazophenyl)hydrazono]naphthalene-1,3-disulfonate Formula: C38H49N5Na2O7S2 MolecularWeight: 797.9345

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNCC(CC)CCCC.C1=CC=C(C=C1)N=NC2=CC=C(C=C2)NN=C3C(=O)C=CC4=CC(=CC(=C43)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CCCCC(CC)CNCC(CC)CCCC.C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N/N=C/3\C(=O)C=CC4=CC(=CC(=C43)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C22H16N4O7S2.C16H35N.2Na/c27-19-11-6-14-12-18(34(28,29)30)13-20(35(31,32)33)21(14)22(19)26-25-17-9-7-16(8-10-17)24-23-15-4-2-1-3-5-15;1-5-9-11-15(7-3)13-17-14-16(8-4)12-10-6-2;;/h1-13,25H,(H,28,29,30)(H,31,32,33);15-17H,5-14H2,1-4H3;;/q;;2*+1/p-2/b24-23?,26-22+;;;