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

Systemtic Name: 1-[3-azanyl-4-(butanoylamino)-2-oxidanyl-cyclohexyl]propan-2-yl propanoate Openeye Name: [2-[3-amino-4-(butanoylamino)-2-hydroxy-cyclohexyl]-1-methyl-ethyl] propanoate CAS Name: propanoic acid 1-[3-amino-2-hydroxy-4-(1-oxobutylamino)cyclohexyl]propan-2-yl ester IUPAC Name: 1-[3-amino-4-(butanoylamino)-2-hydroxycyclohexyl]propan-2-yl propanoate Traditional Name: propionic acid [2-(3-amino-4-butyramido-2-hydroxy-cyclohexyl)-1-methyl-ethyl] ester Formula: C16H30N2O4 MolecularWeight: 314.4204

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H30N2O4/c1-4-6-13(19)18-12-8-7-11(16(21)15(12)17)9-10(3)22-14(20)5-2/h10-12,15-16,21H,4-9,17H2,1-3H3,(H,18,19)