pentadecan-3-yl 3-methylbenzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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