4-cyclohexyl-2-(naphthalen-1-ylmethyl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-cyclohexyl-2-(naphthalen-1-ylmethyl)-4-oxidanylidene-butanoic acid Openeye Name: 4-cyclohexyl-2-(1-naphthylmethyl)-4-oxo-butanoic acid CAS Name: 4-cyclohexyl-2-(1-naphthalenylmethyl)-4-oxobutanoic acid IUPAC Name: 4-cyclohexyl-2-(naphthalen-1-ylmethyl)-4-oxobutanoic acid Traditional Name: 4-cyclohexyl-4-keto-2-(1-naphthylmethyl)butyric acid Formula: C21H24O3 MolecularWeight: 324.41346

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)CC(CC2=CC=CC3=CC=CC=C32)C(=O)O

Isomeric SMILES

C1CCC(CC1)C(=O)CC(CC2=CC=CC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C21H24O3/c22-20(16-8-2-1-3-9-16)14-18(21(23)24)13-17-11-6-10-15-7-4-5-12-19(15)17/h4-7,10-12,16,18H,1-3,8-9,13-14H2,(H,23,24)