2-[[4-cyano-4-(3-cyclopentyloxy-4-methoxy-phenyl)cyclohexyl]amino]-2-oxidanylidene-ethanoate

Systemtic Name: 2-[[4-cyano-4-(3-cyclopentyloxy-4-methoxy-phenyl)cyclohexyl]amino]-2-oxidanylidene-ethanoate Openeye Name: 2-[[4-cyano-4-[3-(cyclopentoxy)-4-methoxy-phenyl]cyclohexyl]amino]-2-oxo-acetate CAS Name: 2-[[4-cyano-4-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexyl]amino]-2-oxoacetate IUPAC Name: 2-[[4-cyano-4-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexyl]amino]-2-oxoacetate Traditional Name: 2-[[4-cyano-4-[3-(cyclopentoxy)-4-methoxy-phenyl]cyclohexyl]amino]-2-keto-acetate Formula: C21H25N2O5- MolecularWeight: 385.4336

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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