[4-cyano-4-(3-cyclopentyloxy-4-methoxy-phenyl)cyclohexyl]carbonylcarbamic acid

Systemtic Name: [4-cyano-4-(3-cyclopentyloxy-4-methoxy-phenyl)cyclohexyl]carbonylcarbamic acid Openeye Name: [4-cyano-4-[3-(cyclopentoxy)-4-methoxy-phenyl]cyclohexanecarbonyl]carbamic acid CAS Name: [[4-cyano-4-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexyl]-oxomethyl]carbamic acid IUPAC Name: [4-cyano-4-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexanecarbonyl]carbamic acid Traditional Name: [4-cyano-4-[3-(cyclopentoxy)-4-methoxy-phenyl]cyclohexanecarbonyl]carbamic acid Formula: C21H26N2O5 MolecularWeight: 386.44154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CCC(CC2)C(=O)NC(=O)O)C#N)OC3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C2(CCC(CC2)C(=O)NC(=O)O)C#N)OC3CCCC3

InChI

InChI=1S/C21H26N2O5/c1-27-17-7-6-15(12-18(17)28-16-4-2-3-5-16)21(13-22)10-8-14(9-11-21)19(24)23-20(25)26/h6-7,12,14,16H,2-5,8-11H2,1H3,(H,23,24)(H,25,26)