2-[[2-cyclohexyl-2-[5-(4-methoxyphenyl)pentanoylamino]ethanoyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[2-cyclohexyl-2-[5-(4-methoxyphenyl)pentanoylamino]ethanoyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[[2-cyclohexyl-2-[5-(4-methoxyphenyl)pentanoylamino]acetyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[2-cyclohexyl-2-[[5-(4-methoxyphenyl)-1-oxopentyl]amino]-1-oxoethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[2-cyclohexyl-2-[5-(4-methoxyphenyl)pentanoylamino]acetyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[2-cyclohexyl-2-[5-(4-methoxyphenyl)pentanoylamino]acetyl]amino]-3-phenyl-propionic acid Formula: C29H38N2O5 MolecularWeight: 494.62242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H38N2O5/c1-36-24-18-16-21(17-19-24)10-8-9-15-26(32)31-27(23-13-6-3-7-14-23)28(33)30-25(29(34)35)20-22-11-4-2-5-12-22/h2,4-5,11-12,16-19,23,25,27H,3,6-10,13-15,20H2,1H3,(H,30,33)(H,31,32)(H,34,35)