pentadecan-5-yl 2-methylbenzoate

Systemtic Name: pentadecan-5-yl 2-methylbenzoate Openeye Name: 1-butylundecyl 2-methylbenzoate CAS Name: 2-methylbenzoic acid pentadecan-5-yl ester IUPAC Name: pentadecan-5-yl 2-methylbenzoate Traditional Name: 2-methylbenzoic acid 1-butylundecyl ester Formula: C23H38O2 MolecularWeight: 346.54662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(CCCC)OC(=O)C1=CC=CC=C1C

Isomeric SMILES

CCCCCCCCCCC(CCCC)OC(=O)C1=CC=CC=C1C

InChI

InChI=1S/C23H38O2/c1-4-6-8-9-10-11-12-13-18-21(17-7-5-2)25-23(24)22-19-15-14-16-20(22)3/h14-16,19,21H,4-13,17-18H2,1-3H3