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4-(1-adamantylmethyl)benzoic acid

4-(1-adamantylmethyl)benzoic acid

Systemtic Name:4-(1-adamantylmethyl)benzoic acid
Openeye Name:4-(1-adamantylmethyl)benzoic acid
CAS Name:4-(1-adamantylmethyl)benzoic acid
IUPAC Name:4-(1-adamantylmethyl)benzoic acid
Traditional Name:4-(1-adamantylmethyl)benzoic acid
Formula: C18H22O2
MolecularWeight: 270.36608
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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CC4=CC=C(C=C4)C(=O)O


Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CC4=CC=C(C=C4)C(=O)O


InChI

InChI=1S/C18H22O2/c19-17(20)16-3-1-12(2-4-16)8-18-9-13-5-14(10-18)7-15(6-13)11-18/h1-4,13-15H,5-11H2,(H,19,20)


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