butanoate; methanoyl-phenoxy-di(propan-2-yl)azanium

Systemtic Name: butanoate; methanoyl-phenoxy-di(propan-2-yl)azanium Openeye Name: butanoate; formyl-diisopropyl-phenoxy-ammonium CAS Name: butanoate; formyl-phenoxy-di(propan-2-yl)ammonium IUPAC Name: butanoate; formyl-phenoxy-di(propan-2-yl)azanium Traditional Name: butyrate; formyl-diisopropyl-phenoxy-ammonium Formula: C17H27NO4 MolecularWeight: 309.40058

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)[O-].CC(C)[N+](C=O)(C(C)C)OC1=CC=CC=C1

Isomeric SMILES

CCCC(=O)[O-].CC(C)[N+](C=O)(C(C)C)OC1=CC=CC=C1

InChI

InChI=1S/C13H20NO2.C4H8O2/c1-11(2)14(10-15,12(3)4)16-13-8-6-5-7-9-13;1-2-3-4(5)6/h5-12H,1-4H3;2-3H2,1H3,(H,5,6)/q+1;/p-1