4-[[(4-bromophenyl)methoxycarbonylamino]methyl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[(4-bromophenyl)methoxycarbonylamino]methyl]cyclohexane-1-carboxylic acid Openeye Name: 4-[[(4-bromophenyl)methoxycarbonylamino]methyl]cyclohexanecarboxylic acid CAS Name: 4-[[[(4-bromophenyl)methoxy-oxomethyl]amino]methyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[(4-bromophenyl)methoxycarbonylamino]methyl]cyclohexane-1-carboxylic acid Traditional Name: 4-[[(4-bromobenzyl)oxycarbonylamino]methyl]cyclohexanecarboxylic acid Formula: C16H20BrNO4 MolecularWeight: 370.2383

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CNC(=O)OCC2=CC=C(C=C2)Br)C(=O)O

Isomeric SMILES

C1CC(CCC1CNC(=O)OCC2=CC=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C16H20BrNO4/c17-14-7-3-12(4-8-14)10-22-16(21)18-9-11-1-5-13(6-2-11)15(19)20/h3-4,7-8,11,13H,1-2,5-6,9-10H2,(H,18,21)(H,19,20)