ethyl 4-henicosan-4-yl-3-methoxy-benzoate

Systemtic Name: ethyl 4-henicosan-4-yl-3-methoxy-benzoate Openeye Name: ethyl 3-methoxy-4-(1-propyloctadecyl)benzoate CAS Name: 4-heneicosan-4-yl-3-methoxybenzoic acid ethyl ester IUPAC Name: ethyl 4-henicosan-4-yl-3-methoxybenzoate Traditional Name: 3-methoxy-4-(1-propyloctadecyl)benzoic acid ethyl ester Formula: C31H54O3 MolecularWeight: 474.75866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(CCC)C1=C(C=C(C=C1)C(=O)OCC)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(CCC)C1=C(C=C(C=C1)C(=O)OCC)OC

InChI

InChI=1S/C31H54O3/c1-5-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-27(22-6-2)29-25-24-28(26-30(29)33-4)31(32)34-7-3/h24-27H,5-23H2,1-4H3