3-[(2S,4R)-2-[(3-methoxyphenyl)methyl]-4-methyl-6-oxidanylidene-cyclohexyl]propanoic acid

Systemtic Name: 3-[(2S,4R)-2-[(3-methoxyphenyl)methyl]-4-methyl-6-oxidanylidene-cyclohexyl]propanoic acid Openeye Name: 3-[(2S,4R)-2-[(3-methoxyphenyl)methyl]-4-methyl-6-oxo-cyclohexyl]propanoic acid CAS Name: 3-[(2S,4R)-2-[(3-methoxyphenyl)methyl]-4-methyl-6-oxocyclohexyl]propanoic acid IUPAC Name: 3-[(2S,4R)-2-[(3-methoxyphenyl)methyl]-4-methyl-6-oxocyclohexyl]propanoic acid Traditional Name: 3-[(4R,6S)-2-keto-6-m-anisyl-4-methyl-cyclohexyl]propionic acid Formula: C18H24O4 MolecularWeight: 304.38076

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(C(=O)C1)CCC(=O)O)CC2=CC(=CC=C2)OC

Isomeric SMILES

C[C@@H]1C[C@H](C(C(=O)C1)CCC(=O)O)CC2=CC(=CC=C2)OC

InChI

InChI=1S/C18H24O4/c1-12-8-14(10-13-4-3-5-15(11-13)22-2)16(17(19)9-12)6-7-18(20)21/h3-5,11-12,14,16H,6-10H2,1-2H3,(H,20,21)/t12-,14+,16?/m1/s1