tridecan-2-yl 4-butylbenzoate

Systemtic Name: tridecan-2-yl 4-butylbenzoate Openeye Name: 1-methyldodecyl 4-butylbenzoate CAS Name: 4-butylbenzoic acid tridecan-2-yl ester IUPAC Name: tridecan-2-yl 4-butylbenzoate Traditional Name: 4-butylbenzoic acid 1-methyldodecyl ester Formula: C24H40O2 MolecularWeight: 360.5732

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(C)OC(=O)C1=CC=C(C=C1)CCCC

Isomeric SMILES

CCCCCCCCCCCC(C)OC(=O)C1=CC=C(C=C1)CCCC

InChI

InChI=1S/C24H40O2/c1-4-6-8-9-10-11-12-13-14-15-21(3)26-24(25)23-19-17-22(18-20-23)16-7-5-2/h17-21H,4-16H2,1-3H3