4-[3-methyl-4-(4-nonylcyclohexyl)phenyl]butanoate

Systemtic Name: 4-[3-methyl-4-(4-nonylcyclohexyl)phenyl]butanoate Openeye Name: 4-[3-methyl-4-(4-nonylcyclohexyl)phenyl]butanoate CAS Name: 4-[3-methyl-4-(4-nonylcyclohexyl)phenyl]butanoate IUPAC Name: 4-[3-methyl-4-(4-nonylcyclohexyl)phenyl]butanoate Traditional Name: 4-[3-methyl-4-(4-nonylcyclohexyl)phenyl]butyrate Formula: C26H41O2- MolecularWeight: 385.60254

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1CCC(CC1)C2=C(C=C(C=C2)CCCC(=O)[O-])C

Isomeric SMILES

CCCCCCCCCC1CCC(CC1)C2=C(C=C(C=C2)CCCC(=O)[O-])C

InChI

InChI=1S/C26H42O2/c1-3-4-5-6-7-8-9-11-22-14-17-24(18-15-22)25-19-16-23(20-21(25)2)12-10-13-26(27)28/h16,19-20,22,24H,3-15,17-18H2,1-2H3,(H,27,28)/p-1