[3-(4-tert-butylphenyl)-1-methoxy-propyl] heptanoate

Systemtic Name: [3-(4-tert-butylphenyl)-1-methoxy-propyl] heptanoate Openeye Name: [3-(4-tert-butylphenyl)-1-methoxy-propyl] heptanoate CAS Name: heptanoic acid [3-(4-tert-butylphenyl)-1-methoxypropyl] ester IUPAC Name: [3-(4-tert-butylphenyl)-1-methoxypropyl] heptanoate Traditional Name: enanthic acid [3-(4-tert-butylphenyl)-1-methoxy-propyl] ester Formula: C21H34O3 MolecularWeight: 334.49286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)OC(CCC1=CC=C(C=C1)C(C)(C)C)OC

Isomeric SMILES

CCCCCCC(=O)OC(CCC1=CC=C(C=C1)C(C)(C)C)OC

InChI

InChI=1S/C21H34O3/c1-6-7-8-9-10-19(22)24-20(23-5)16-13-17-11-14-18(15-12-17)21(2,3)4/h11-12,14-15,20H,6-10,13,16H2,1-5H3