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3-(1-adamantyl)-1-(4-ethylphenyl)naphthalene-2-carboxylic acid

3-(1-adamantyl)-1-(4-ethylphenyl)naphthalene-2-carboxylic acid

Systemtic Name:3-(1-adamantyl)-1-(4-ethylphenyl)naphthalene-2-carboxylic acid
Openeye Name:3-(1-adamantyl)-1-(4-ethylphenyl)naphthalene-2-carboxylic acid
CAS Name:3-(1-adamantyl)-1-(4-ethylphenyl)-2-naphthalenecarboxylic acid
IUPAC Name:3-(1-adamantyl)-1-(4-ethylphenyl)naphthalene-2-carboxylic acid
Traditional Name:3-(1-adamantyl)-1-(4-ethylphenyl)-2-naphthoic acid
Formula: C29H30O2
MolecularWeight: 410.5473
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=C(C(=CC3=CC=CC=C32)C45CC6CC(C4)CC(C6)C5)C(=O)O


Isomeric SMILES

CCC1=CC=C(C=C1)C2=C(C(=CC3=CC=CC=C32)C45CC6CC(C4)CC(C6)C5)C(=O)O


InChI

InChI=1S/C29H30O2/c1-2-18-7-9-22(10-8-18)26-24-6-4-3-5-23(24)14-25(27(26)28(30)31)29-15-19-11-20(16-29)13-21(12-19)17-29/h3-10,14,19-21H,2,11-13,15-17H2,1H3,(H,30,31)


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