2-(3,3-dicyclohexylpropanoylamino)-3-(2,5-dimethoxyphenyl)propanoic acid

Systemtic Name: 2-(3,3-dicyclohexylpropanoylamino)-3-(2,5-dimethoxyphenyl)propanoic acid Openeye Name: 2-(3,3-dicyclohexylpropanoylamino)-3-(2,5-dimethoxyphenyl)propanoic acid CAS Name: 2-[(3,3-dicyclohexyl-1-oxopropyl)amino]-3-(2,5-dimethoxyphenyl)propanoic acid IUPAC Name: 2-(3,3-dicyclohexylpropanoylamino)-3-(2,5-dimethoxyphenyl)propanoic acid Traditional Name: 2-(3,3-dicyclohexylpropanoylamino)-3-(2,5-dimethoxyphenyl)propionic acid Formula: C26H39NO5 MolecularWeight: 445.59156

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CC(C(=O)O)NC(=O)CC(C2CCCCC2)C3CCCCC3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CC(C(=O)O)NC(=O)CC(C2CCCCC2)C3CCCCC3

InChI

InChI=1S/C26H39NO5/c1-31-21-13-14-24(32-2)20(15-21)16-23(26(29)30)27-25(28)17-22(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h13-15,18-19,22-23H,3-12,16-17H2,1-2H3,(H,27,28)(H,29,30)