naphthalene-1-sulfonate; tributyl-[(4-chlorophenyl)methyl]azanium

Systemtic Name: naphthalene-1-sulfonate; tributyl-[(4-chlorophenyl)methyl]azanium Openeye Name: naphthalene-1-sulfonate; tributyl-[(4-chlorophenyl)methyl]ammonium CAS Name: 1-naphthalenesulfonate; tributyl-[(4-chlorophenyl)methyl]ammonium IUPAC Name: naphthalene-1-sulfonate; tributyl-[(4-chlorophenyl)methyl]azanium Traditional Name: naphthalene-1-sulfonate; tributyl-(4-chlorobenzyl)ammonium Formula: C29H40ClNO3S MolecularWeight: 518.1508

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H33ClN.C10H8O3S/c1-4-7-14-21(15-8-5-2,16-9-6-3)17-18-10-12-19(20)13-11-18;11-14(12,13)10-7-3-5-8-4-1-2-6-9(8)10/h10-13H,4-9,14-17H2,1-3H3;1-7H,(H,11,12,13)/q+1;/p-1