4-azanylnaphthalene-1-sulfonate; tributyl-(phenylmethyl)azanium

Systemtic Name: 4-azanylnaphthalene-1-sulfonate; tributyl-(phenylmethyl)azanium Openeye Name: 4-aminonaphthalene-1-sulfonate; benzyl(tributyl)ammonium CAS Name: 4-amino-1-naphthalenesulfonate; tributyl-(phenylmethyl)ammonium IUPAC Name: 4-aminonaphthalene-1-sulfonate; benzyl(tributyl)azanium Traditional Name: benzyl(tributyl)ammonium dansate Formula: C29H42N2O3S MolecularWeight: 498.72038

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CCCC)(CCCC)CC1=CC=CC=C1.C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)[O-])N

Isomeric SMILES

CCCC[N+](CCCC)(CCCC)CC1=CC=CC=C1.C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)[O-])N

InChI

InChI=1S/C19H34N.C10H9NO3S/c1-4-7-15-20(16-8-5-2,17-9-6-3)18-19-13-11-10-12-14-19;11-9-5-6-10(15(12,13)14)8-4-2-1-3-7(8)9/h10-14H,4-9,15-18H2,1-3H3;1-6H,11H2,(H,12,13,14)/q+1;/p-1