pentadecan-2-yl 3-methylbenzoate

Systemtic Name: pentadecan-2-yl 3-methylbenzoate Openeye Name: 1-methyltetradecyl 3-methylbenzoate CAS Name: 3-methylbenzoic acid pentadecan-2-yl ester IUPAC Name: pentadecan-2-yl 3-methylbenzoate Traditional Name: 3-methylbenzoic acid 1-methyltetradecyl ester Formula: C23H38O2 MolecularWeight: 346.54662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(C)OC(=O)C1=CC(=CC=C1)C

Isomeric SMILES

CCCCCCCCCCCCCC(C)OC(=O)C1=CC(=CC=C1)C

InChI

InChI=1S/C23H38O2/c1-4-5-6-7-8-9-10-11-12-13-14-17-21(3)25-23(24)22-18-15-16-20(2)19-22/h15-16,18-19,21H,4-14,17H2,1-3H3