[(5R)-5-methyl-2-propan-2-yl-cyclohexyl] (1R,2R,3S)-2-morpholin-4-ylcarbonyl-3-phenyl-cyclopropane-1-carboxylate

Systemtic Name: [(5R)-5-methyl-2-propan-2-yl-cyclohexyl] (1R,2R,3S)-2-morpholin-4-ylcarbonyl-3-phenyl-cyclopropane-1-carboxylate Openeye Name: [(5R)-2-isopropyl-5-methyl-cyclohexyl] (1R,2R,3S)-2-(morpholine-4-carbonyl)-3-phenyl-cyclopropanecarboxylate CAS Name: (1R,2R,3S)-2-[4-morpholinyl(oxo)methyl]-3-phenyl-1-cyclopropanecarboxylic acid [(5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(5R)-5-methyl-2-propan-2-ylcyclohexyl] (1R,2R,3S)-2-(morpholine-4-carbonyl)-3-phenylcyclopropane-1-carboxylate Traditional Name: (1R,2R,3S)-2-(morpholine-4-carbonyl)-3-phenyl-cyclopropanecarboxylic acid [(5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C25H35NO4 MolecularWeight: 413.5497

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C2C(C2C(=O)N3CCOCC3)C4=CC=CC=C4)C(C)C

Isomeric SMILES

C[C@@H]1CCC(C(C1)OC(=O)[C@@H]2[C@H]([C@H]2C(=O)N3CCOCC3)C4=CC=CC=C4)C(C)C

InChI

InChI=1S/C25H35NO4/c1-16(2)19-10-9-17(3)15-20(19)30-25(28)23-21(18-7-5-4-6-8-18)22(23)24(27)26-11-13-29-14-12-26/h4-8,16-17,19-23H,9-15H2,1-3H3/t17-,19?,20?,21+,22-,23-/m1/s1