(5-methyl-2-propan-2-yl-cyclohexyl) 3-benzamido-2-oxidanyl-3-phenyl-propanoate

Systemtic Name: (5-methyl-2-propan-2-yl-cyclohexyl) 3-benzamido-2-oxidanyl-3-phenyl-propanoate Openeye Name: (2-isopropyl-5-methyl-cyclohexyl) 3-benzamido-2-hydroxy-3-phenyl-propanoate CAS Name: 3-benzamido-2-hydroxy-3-phenylpropanoic acid (5-methyl-2-propan-2-ylcyclohexyl) ester IUPAC Name: (5-methyl-2-propan-2-ylcyclohexyl) 3-benzamido-2-hydroxy-3-phenylpropanoate Traditional Name: 3-benzamido-2-hydroxy-3-phenyl-propionic acid (2-isopropyl-5-methyl-cyclohexyl) ester Formula: C26H33NO4 MolecularWeight: 423.54452

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C(C(C2=CC=CC=C2)NC(=O)C3=CC=CC=C3)O)C(C)C

Isomeric SMILES

CC1CCC(C(C1)OC(=O)C(C(C2=CC=CC=C2)NC(=O)C3=CC=CC=C3)O)C(C)C

InChI

InChI=1S/C26H33NO4/c1-17(2)21-15-14-18(3)16-22(21)31-26(30)24(28)23(19-10-6-4-7-11-19)27-25(29)20-12-8-5-9-13-20/h4-13,17-18,21-24,28H,14-16H2,1-3H3,(H,27,29)