(2-butanoyloxy-4-methanoyl-phenyl) butanoate; N,2-dimethylpropan-2-amine; hydrochloride

Systemtic Name: (2-butanoyloxy-4-methanoyl-phenyl) butanoate; N,2-dimethylpropan-2-amine; hydrochloride Openeye Name: (2-butanoyloxy-4-formyl-phenyl) butanoate; N,2-dimethylpropan-2-amine; hydrochloride CAS Name: butanoic acid [4-formyl-2-(1-oxobutoxy)phenyl] ester; N,2-dimethyl-2-propanamine; hydrochloride IUPAC Name: (2-butanoyloxy-4-formylphenyl) butanoate; N,2-dimethylpropan-2-amine; hydrochloride Traditional Name: tert-butyl(methyl)amine; butyric acid (2-butyryloxy-4-formyl-phenyl) ester; hydrochloride Formula: C20H32ClNO5 MolecularWeight: 401.92478

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=C(C=C(C=C1)C=O)OC(=O)CCC.CC(C)(C)NC.Cl

Isomeric SMILES

CCCC(=O)OC1=C(C=C(C=C1)C=O)OC(=O)CCC.CC(C)(C)NC.Cl

InChI

InChI=1S/C15H18O5.C5H13N.ClH/c1-3-5-14(17)19-12-8-7-11(10-16)9-13(12)20-15(18)6-4-2;1-5(2,3)6-4;/h7-10H,3-6H2,1-2H3;6H,1-4H3;1H