4-[2-(4-aminophenyl)ethynyl]-4-(3-cyclopentyloxy-4-methoxy-phenyl)cyclohexan-1-one

Systemtic Name: 4-[2-(4-aminophenyl)ethynyl]-4-(3-cyclopentyloxy-4-methoxy-phenyl)cyclohexan-1-one Openeye Name: 4-[2-(4-aminophenyl)ethynyl]-4-[3-(cyclopentoxy)-4-methoxy-phenyl]cyclohexanone CAS Name: 4-[2-(4-aminophenyl)ethynyl]-4-(3-cyclopentyloxy-4-methoxyphenyl)-1-cyclohexanone IUPAC Name: 4-[2-(4-aminophenyl)ethynyl]-4-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexan-1-one Traditional Name: 4-[2-(4-aminophenyl)ethynyl]-4-[3-(cyclopentoxy)-4-methoxy-phenyl]cyclohexanone Formula: C26H29NO3 MolecularWeight: 403.51336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CCC(=O)CC2)C#CC3=CC=C(C=C3)N)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C2(CCC(=O)CC2)C#CC3=CC=C(C=C3)N)OC4CCCC4

InChI

InChI=1S/C26H29NO3/c1-29-24-11-8-20(18-25(24)30-23-4-2-3-5-23)26(16-13-22(28)14-17-26)15-12-19-6-9-21(27)10-7-19/h6-11,18,23H,2-5,13-14,16-17,27H2,1H3