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2-(2-carboxyphenyl)sulfinylbenzoate; tetrabutylazanium

2-(2-carboxyphenyl)sulfinylbenzoate; tetrabutylazanium

Systemtic Name:2-(2-carboxyphenyl)sulfinylbenzoate; tetrabutylazanium
Openeye Name:2-(2-carboxyphenyl)sulfinylbenzoate; tetrabutylammonium
CAS Name:2-(2-carboxyphenyl)sulfinylbenzoate; tetrabutylammonium
IUPAC Name:2-(2-carboxyphenyl)sulfinylbenzoate; tetrabutylazanium
Traditional Name:2-(2-carboxyphenyl)sulfinylbenzoate; tetrabutylammonium
Formula: C30H45NO5S
MolecularWeight: 531.747
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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CCCC)(CCCC)CCCC.C1=CC=C(C(=C1)C(=O)O)S(=O)C2=CC=CC=C2C(=O)[O-]


Isomeric SMILES

CCCC[N+](CCCC)(CCCC)CCCC.C1=CC=C(C(=C1)C(=O)O)S(=O)C2=CC=CC=C2C(=O)[O-]


InChI

InChI=1S/C16H36N.C14H10O5S/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;15-13(16)9-5-1-3-7-11(9)20(19)12-8-4-2-6-10(12)14(17)18/h5-16H2,1-4H3;1-8H,(H,15,16)(H,17,18)/q+1;/p-1


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