4-[1-azanyl-2-(1-butanoyloxy-2-methyl-propoxy)-2-oxidanylidene-ethyl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[1-azanyl-2-(1-butanoyloxy-2-methyl-propoxy)-2-oxidanylidene-ethyl]cyclohexane-1-carboxylic acid Openeye Name: 4-[1-amino-2-(1-butanoyloxy-2-methyl-propoxy)-2-oxo-ethyl]cyclohexanecarboxylic acid CAS Name: 4-[1-amino-2-[2-methyl-1-(1-oxobutoxy)propoxy]-2-oxoethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[1-amino-2-(1-butanoyloxy-2-methylpropoxy)-2-oxoethyl]cyclohexane-1-carboxylic acid Traditional Name: 4-[1-amino-2-(1-butyryloxy-2-methyl-propoxy)-2-keto-ethyl]cyclohexanecarboxylic acid Formula: C17H29NO6 MolecularWeight: 343.41526

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC(C(C)C)OC(=O)C(C1CCC(CC1)C(=O)O)N

Isomeric SMILES

CCCC(=O)OC(C(C)C)OC(=O)C(C1CCC(CC1)C(=O)O)N

InChI

InChI=1S/C17H29NO6/c1-4-5-13(19)23-17(10(2)3)24-16(22)14(18)11-6-8-12(9-7-11)15(20)21/h10-12,14,17H,4-9,18H2,1-3H3,(H,20,21)