1-[3-azanyl-4-(butanoylamino)-2-oxidanyl-cyclohexyl]propan-2-yl ethanoate hydrochloride

Systemtic Name: 1-[3-azanyl-4-(butanoylamino)-2-oxidanyl-cyclohexyl]propan-2-yl ethanoate hydrochloride Openeye Name: [2-[3-amino-4-(butanoylamino)-2-hydroxy-cyclohexyl]-1-methyl-ethyl] acetate hydrochloride CAS Name: acetic acid 1-[3-amino-2-hydroxy-4-(1-oxobutylamino)cyclohexyl]propan-2-yl ester hydrochloride IUPAC Name: 1-[3-amino-4-(butanoylamino)-2-hydroxycyclohexyl]propan-2-yl acetate hydrochloride Traditional Name: acetic acid [2-(3-amino-4-butyramido-2-hydroxy-cyclohexyl)-1-methyl-ethyl] ester hydrochloride Formula: C15H29ClN2O4 MolecularWeight: 336.85476

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1CCC(C(C1N)O)CC(C)OC(=O)C.Cl

Isomeric SMILES

CCCC(=O)NC1CCC(C(C1N)O)CC(C)OC(=O)C.Cl

InChI

InChI=1S/C15H28N2O4.ClH/c1-4-5-13(19)17-12-7-6-11(15(20)14(12)16)8-9(2)21-10(3)18;/h9,11-12,14-15,20H,4-8,16H2,1-3H3,(H,17,19);1H