[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 4-methanoylbenzoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 4-methanoylbenzoate Openeye Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] 4-formylbenzoate CAS Name: 4-formylbenzoic acid [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 4-formylbenzoate Traditional Name: 4-formylbenzoic acid [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C18H24O3 MolecularWeight: 288.38136

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)C2=CC=C(C=C2)C=O)C(C)C

InChI

InChI=1S/C18H24O3/c1-12(2)16-9-4-13(3)10-17(16)21-18(20)15-7-5-14(11-19)6-8-15/h5-8,11-13,16-17H,4,9-10H2,1-3H3/t13-,16+,17-/m1/s1