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2-[(1R,4S)-4-methyl-2-oxidanylidene-cyclohexyl]propanoic acid

2-[(1R,4S)-4-methyl-2-oxidanylidene-cyclohexyl]propanoic acid

Systemtic Name:2-[(1R,4S)-4-methyl-2-oxidanylidene-cyclohexyl]propanoic acid
Openeye Name:2-[(1R,4S)-4-methyl-2-oxo-cyclohexyl]propanoic acid
CAS Name:2-[(1R,4S)-4-methyl-2-oxocyclohexyl]propanoic acid
IUPAC Name:2-[(1R,4S)-4-methyl-2-oxocyclohexyl]propanoic acid
Traditional Name:2-[(1R,4S)-2-keto-4-methyl-cyclohexyl]propionic acid
Formula: C10H16O3
MolecularWeight: 184.23224
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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(=O)C1)C(C)C(=O)O


Isomeric SMILES

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


InChI

InChI=1S/C10H16O3/c1-6-3-4-8(9(11)5-6)7(2)10(12)13/h6-8H,3-5H2,1-2H3,(H,12,13)/t6-,7?,8+/m0/s1


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