octadecyl 4-chloranylbenzoate

Systemtic Name: octadecyl 4-chloranylbenzoate Openeye Name: octadecyl 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid octadecyl ester IUPAC Name: octadecyl 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid stearyl ester Formula: C25H41ClO2 MolecularWeight: 409.04484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C25H41ClO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-28-25(27)23-18-20-24(26)21-19-23/h18-21H,2-17,22H2,1H3