2-oxidanylidene-2-phenylmethoxy-ethanoic acid; tetrabutylazanium

Systemtic Name: 2-oxidanylidene-2-phenylmethoxy-ethanoic acid; tetrabutylazanium Openeye Name: 2-benzyloxy-2-oxo-acetic acid; tetrabutylammonium CAS Name: 2-oxo-2-phenylmethoxyacetic acid; tetrabutylammonium IUPAC Name: 2-oxo-2-phenylmethoxyacetic acid; tetrabutylazanium Traditional Name: 2-benzoxy-2-keto-acetic acid; tetrabutylammonium Formula: C25H44NO4+ MolecularWeight: 422.62116

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CCCC)(CCCC)CCCC.C1=CC=C(C=C1)COC(=O)C(=O)O

Isomeric SMILES

CCCC[N+](CCCC)(CCCC)CCCC.C1=CC=C(C=C1)COC(=O)C(=O)O

InChI

InChI=1S/C16H36N.C9H8O4/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;10-8(11)9(12)13-6-7-4-2-1-3-5-7/h5-16H2,1-4H3;1-5H,6H2,(H,10,11)/q+1;