(1S,2R)-2-[[2-(4-ethylphenoxy)ethanoylamino]carbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: (1S,2R)-2-[[2-(4-ethylphenoxy)ethanoylamino]carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: (1S,2R)-2-[[[2-(4-ethylphenoxy)acetyl]amino]carbamoyl]cyclohexanecarboxylic acid CAS Name: (1S,2R)-2-[[[2-(4-ethylphenoxy)-1-oxoethyl]hydrazo]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: (1S,2R)-2-[[[2-(4-ethylphenoxy)acetyl]amino]carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: (1S,2R)-2-[[[2-(4-ethylphenoxy)acetyl]amino]carbamoyl]cyclohexanecarboxylic acid Formula: C18H24N2O5 MolecularWeight: 348.39356

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC(=O)NNC(=O)C2CCCCC2C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)OCC(=O)NNC(=O)[C@@H]2CCCC[C@@H]2C(=O)O

InChI

InChI=1S/C18H24N2O5/c1-2-12-7-9-13(10-8-12)25-11-16(21)19-20-17(22)14-5-3-4-6-15(14)18(23)24/h7-10,14-15H,2-6,11H2,1H3,(H,19,21)(H,20,22)(H,23,24)/t14-,15+/m1/s1