2-[[2-cyclohexyl-2-[4-(4-methoxyphenyl)butanoylamino]ethanoyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[2-cyclohexyl-2-[4-(4-methoxyphenyl)butanoylamino]ethanoyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[[2-cyclohexyl-2-[4-(4-methoxyphenyl)butanoylamino]acetyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[2-cyclohexyl-2-[[4-(4-methoxyphenyl)-1-oxobutyl]amino]-1-oxoethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[2-cyclohexyl-2-[4-(4-methoxyphenyl)butanoylamino]acetyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[2-cyclohexyl-2-[4-(4-methoxyphenyl)butanoylamino]acetyl]amino]-3-phenyl-propionic acid Formula: C28H36N2O5 MolecularWeight: 480.59584

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCCC(=O)NC(C2CCCCC2)C(=O)NC(CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)CCCC(=O)NC(C2CCCCC2)C(=O)NC(CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C28H36N2O5/c1-35-23-17-15-20(16-18-23)11-8-14-25(31)30-26(22-12-6-3-7-13-22)27(32)29-24(28(33)34)19-21-9-4-2-5-10-21/h2,4-5,9-10,15-18,22,24,26H,3,6-8,11-14,19H2,1H3,(H,29,32)(H,30,31)(H,33,34)