(1R,2S)-2-[[2-(4-chloranylphenoxy)ethanoylamino]carbamoyl]cyclohexane-1-carboxylate

Systemtic Name: (1R,2S)-2-[[2-(4-chloranylphenoxy)ethanoylamino]carbamoyl]cyclohexane-1-carboxylate Openeye Name: (1R,2S)-2-[[[2-(4-chlorophenoxy)acetyl]amino]carbamoyl]cyclohexanecarboxylate CAS Name: (1R,2S)-2-[[[2-(4-chlorophenoxy)-1-oxoethyl]hydrazo]-oxomethyl]-1-cyclohexanecarboxylate IUPAC Name: (1R,2S)-2-[[[2-(4-chlorophenoxy)acetyl]amino]carbamoyl]cyclohexane-1-carboxylate Traditional Name: (1R,2S)-2-[[[2-(4-chlorophenoxy)acetyl]amino]carbamoyl]cyclohexanecarboxylate Formula: C16H18ClN2O5- MolecularWeight: 353.77752

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)NNC(=O)COC2=CC=C(C=C2)Cl)C(=O)[O-]

Isomeric SMILES

C1CC[C@H]([C@H](C1)C(=O)NNC(=O)COC2=CC=C(C=C2)Cl)C(=O)[O-]

InChI

InChI=1S/C16H19ClN2O5/c17-10-5-7-11(8-6-10)24-9-14(20)18-19-15(21)12-3-1-2-4-13(12)16(22)23/h5-8,12-13H,1-4,9H2,(H,18,20)(H,19,21)(H,22,23)/p-1/t12-,13+/m0/s1