8-ethanoyl-8-(4-methoxyphenyl)-12-phenylmethoxy-heptadecanoic acid

Systemtic Name: 8-ethanoyl-8-(4-methoxyphenyl)-12-phenylmethoxy-heptadecanoic acid Openeye Name: 8-acetyl-12-benzyloxy-8-(4-methoxyphenyl)heptadecanoic acid CAS Name: 8-acetyl-8-(4-methoxyphenyl)-12-phenylmethoxyheptadecanoic acid IUPAC Name: 8-acetyl-8-(4-methoxyphenyl)-12-phenylmethoxyheptadecanoic acid Traditional Name: 8-acetyl-12-benzoxy-8-(4-methoxyphenyl)heptadecanoic acid Formula: C33H48O5 MolecularWeight: 524.73122

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCCC(CCCCCCC(=O)O)(C1=CC=C(C=C1)OC)C(=O)C)OCC2=CC=CC=C2

Isomeric SMILES

CCCCCC(CCCC(CCCCCCC(=O)O)(C1=CC=C(C=C1)OC)C(=O)C)OCC2=CC=CC=C2

InChI

InChI=1S/C33H48O5/c1-4-5-9-17-31(38-26-28-15-10-8-11-16-28)18-14-25-33(27(2)34,24-13-7-6-12-19-32(35)36)29-20-22-30(37-3)23-21-29/h8,10-11,15-16,20-23,31H,4-7,9,12-14,17-19,24-26H2,1-3H3,(H,35,36)