tripropylazanium; 3,4,5-tris(oxidanyl)cyclohexene-1-carboxylate

Systemtic Name: tripropylazanium; 3,4,5-tris(oxidanyl)cyclohexene-1-carboxylate Openeye Name: 3,4,5-trihydroxycyclohexene-1-carboxylate; tripropylammonium CAS Name: 3,4,5-trihydroxy-1-cyclohexenecarboxylate; tripropylammonium IUPAC Name: 3,4,5-trihydroxycyclohexene-1-carboxylate; tripropylazanium Traditional Name: 3,4,5-trihydroxycyclohexene-1-carboxylate; tripropylammonium Formula: C16H31NO5 MolecularWeight: 317.42104

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CCC)CCC.C1C(C(C(C=C1C(=O)[O-])O)O)O

Isomeric SMILES

CCC[NH+](CCC)CCC.C1C(C(C(C=C1C(=O)[O-])O)O)O

InChI

InChI=1S/C9H21N.C7H10O5/c1-4-7-10(8-5-2)9-6-3;8-4-1-3(7(11)12)2-5(9)6(4)10/h4-9H2,1-3H3;1,4-6,8-10H,2H2,(H,11,12)