2-dimethylaminoethyl 2-(aminocarbonylcarbamoyl)-2-ethyl-butanoate hydrochloride

Systemtic Name: 2-dimethylaminoethyl 2-(aminocarbonylcarbamoyl)-2-ethyl-butanoate hydrochloride Openeye Name: 2-dimethylaminoethyl 2-allophanoyl-2-ethyl-butanoate hydrochloride CAS Name: 2-[(carbamoylamino)-oxomethyl]-2-ethylbutanoic acid 2-dimethylaminoethyl ester hydrochloride IUPAC Name: 2-dimethylaminoethyl 2-(carbamoylcarbamoyl)-2-ethylbutanoate hydrochloride Traditional Name: 2-allophanoyl-2-ethyl-butyric acid 2-dimethylaminoethyl ester hydrochloride Formula: C12H24ClN3O4 MolecularWeight: 309.78966

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C(=O)NC(=O)N)C(=O)OCCN(C)C.Cl

Isomeric SMILES

CCC(CC)(C(=O)NC(=O)N)C(=O)OCCN(C)C.Cl

InChI

InChI=1S/C12H23N3O4.ClH/c1-5-12(6-2,9(16)14-11(13)18)10(17)19-8-7-15(3)4;/h5-8H2,1-4H3,(H3,13,14,16,18);1H