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4,4-diethyl-5-(hydroxymethyl)adamantane-1,3-dicarboxylic acid

4,4-diethyl-5-(hydroxymethyl)adamantane-1,3-dicarboxylic acid

Systemtic Name:4,4-diethyl-5-(hydroxymethyl)adamantane-1,3-dicarboxylic acid
Openeye Name:4,4-diethyl-5-(hydroxymethyl)adamantane-1,3-dicarboxylic acid
CAS Name:4,4-diethyl-5-(hydroxymethyl)adamantane-1,3-dicarboxylic acid
IUPAC Name:4,4-diethyl-5-(hydroxymethyl)adamantane-1,3-dicarboxylic acid
Traditional Name:4,4-diethyl-5-methylol-adamantane-1,3-dicarboxylic acid
Formula: C17H26O5
MolecularWeight: 310.38534
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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C2(CC3CC(C2)(CC1(C3)C(=O)O)C(=O)O)CO)CC


Isomeric SMILES

CCC1(C2(CC3CC(C2)(CC1(C3)C(=O)O)C(=O)O)CO)CC


InChI

InChI=1S/C17H26O5/c1-3-17(4-2)15(10-18)6-11-5-14(8-15,12(19)20)9-16(17,7-11)13(21)22/h11,18H,3-10H2,1-2H3,(H,19,20)(H,21,22)


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