3-[3-[[(4-cyclohexylphenyl)carbonylamino]methyl]-4-methoxy-phenyl]-2-propan-2-yloxy-propanoic acid

Systemtic Name: 3-[3-[[(4-cyclohexylphenyl)carbonylamino]methyl]-4-methoxy-phenyl]-2-propan-2-yloxy-propanoic acid Openeye Name: 3-[3-[[(4-cyclohexylbenzoyl)amino]methyl]-4-methoxy-phenyl]-2-isopropoxy-propanoic acid CAS Name: 3-[3-[[[(4-cyclohexylphenyl)-oxomethyl]amino]methyl]-4-methoxyphenyl]-2-propan-2-yloxypropanoic acid IUPAC Name: 3-[3-[[(4-cyclohexylbenzoyl)amino]methyl]-4-methoxyphenyl]-2-propan-2-yloxypropanoic acid Traditional Name: 3-[3-[[(4-cyclohexylbenzoyl)amino]methyl]-4-methoxy-phenyl]-2-isopropoxy-propionic acid Formula: C27H35NO5 MolecularWeight: 453.5705

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(CC1=CC(=C(C=C1)OC)CNC(=O)C2=CC=C(C=C2)C3CCCCC3)C(=O)O

Isomeric SMILES

CC(C)OC(CC1=CC(=C(C=C1)OC)CNC(=O)C2=CC=C(C=C2)C3CCCCC3)C(=O)O

InChI

InChI=1S/C27H35NO5/c1-18(2)33-25(27(30)31)16-19-9-14-24(32-3)23(15-19)17-28-26(29)22-12-10-21(11-13-22)20-7-5-4-6-8-20/h9-15,18,20,25H,4-8,16-17H2,1-3H3,(H,28,29)(H,30,31)