5-azanyl-4-(propanoylamino)-3-propoxy-cyclohexene-1-carboxylic acid

Systemtic Name: 5-azanyl-4-(propanoylamino)-3-propoxy-cyclohexene-1-carboxylic acid Openeye Name: 5-amino-4-(propanoylamino)-3-propoxy-cyclohexene-1-carboxylic acid CAS Name: 5-amino-4-(1-oxopropylamino)-3-propoxy-1-cyclohexenecarboxylic acid IUPAC Name: 5-amino-4-(propanoylamino)-3-propoxycyclohexene-1-carboxylic acid Traditional Name: 5-amino-4-propionamido-3-propoxy-cyclohexene-1-carboxylic acid Formula: C13H22N2O4 MolecularWeight: 270.32478

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1C=C(CC(C1NC(=O)CC)N)C(=O)O

Isomeric SMILES

CCCOC1C=C(CC(C1NC(=O)CC)N)C(=O)O

InChI

InChI=1S/C13H22N2O4/c1-3-5-19-10-7-8(13(17)18)6-9(14)12(10)15-11(16)4-2/h7,9-10,12H,3-6,14H2,1-2H3,(H,15,16)(H,17,18)