sodium; 1,4-bis(2-ethylhexoxy)-1,4-bis(oxidanylidene)butane-2-sulfonate; N-phenylnaphthalen-1-amine

Systemtic Name: sodium; 1,4-bis(2-ethylhexoxy)-1,4-bis(oxidanylidene)butane-2-sulfonate; N-phenylnaphthalen-1-amine Openeye Name: sodium; 1,4-bis(2-ethylhexoxy)-1,4-dioxo-butane-2-sulfonate; N-phenylnaphthalen-1-amine CAS Name: sodium; 1,4-bis(2-ethylhexoxy)-1,4-dioxo-2-butanesulfonate; N-phenyl-1-naphthalenamine IUPAC Name: sodium; 1,4-bis(2-ethylhexoxy)-1,4-dioxobutane-2-sulfonate; N-phenylnaphthalen-1-amine Traditional Name: sodium; 1,4-bis(2-ethylhexoxy)-1,4-diketo-butane-2-sulfonate; 1-naphthyl(phenyl)amine Formula: C36H50NNaO7S MolecularWeight: 663.83947

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)[O-].C1=CC=C(C=C1)NC2=CC=CC3=CC=CC=C32.[Na+]

Isomeric SMILES

CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)[O-].C1=CC=C(C=C1)NC2=CC=CC3=CC=CC=C32.[Na+]

InChI

InChI=1S/C20H38O7S.C16H13N.Na/c1-5-9-11-16(7-3)14-26-19(21)13-18(28(23,24)25)20(22)27-15-17(8-4)12-10-6-2;1-2-9-14(10-3-1)17-16-12-6-8-13-7-4-5-11-15(13)16;/h16-18H,5-15H2,1-4H3,(H,23,24,25);1-12,17H;/q;;+1/p-1