phenyl 2-(3-butan-2-yloxypropyl)-3-octoxy-6-phenyl-benzoate

Systemtic Name: phenyl 2-(3-butan-2-yloxypropyl)-3-octoxy-6-phenyl-benzoate Openeye Name: phenyl 3-octoxy-6-phenyl-2-(3-sec-butoxypropyl)benzoate CAS Name: 2-(3-butan-2-yloxypropyl)-3-octoxy-6-phenylbenzoic acid phenyl ester IUPAC Name: phenyl 2-(3-butan-2-yloxypropyl)-3-octoxy-6-phenylbenzoate Traditional Name: 3-octoxy-6-phenyl-2-(3-sec-butoxypropyl)benzoic acid phenyl ester Formula: C34H44O4 MolecularWeight: 516.71076

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C(=C(C=C1)C2=CC=CC=C2)C(=O)OC3=CC=CC=C3)CCCOC(C)CC

Isomeric SMILES

CCCCCCCCOC1=C(C(=C(C=C1)C2=CC=CC=C2)C(=O)OC3=CC=CC=C3)CCCOC(C)CC

InChI

InChI=1S/C34H44O4/c1-4-6-7-8-9-16-25-37-32-24-23-30(28-18-12-10-13-19-28)33(31(32)22-17-26-36-27(3)5-2)34(35)38-29-20-14-11-15-21-29/h10-15,18-21,23-24,27H,4-9,16-17,22,25-26H2,1-3H3