propan-2-yl 4-[3-(4-hexadecylphenyl)-3-oxidanylidene-propanoyl]benzoate

Systemtic Name: propan-2-yl 4-[3-(4-hexadecylphenyl)-3-oxidanylidene-propanoyl]benzoate Openeye Name: isopropyl 4-[3-(4-hexadecylphenyl)-3-oxo-propanoyl]benzoate CAS Name: 4-[3-(4-hexadecylphenyl)-1,3-dioxopropyl]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[3-(4-hexadecylphenyl)-3-oxopropanoyl]benzoate Traditional Name: 4-[3-(4-cetylphenyl)-3-keto-propanoyl]benzoic acid isopropyl ester Formula: C35H50O4 MolecularWeight: 534.7691

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC1=CC=C(C=C1)C(=O)CC(=O)C2=CC=C(C=C2)C(=O)OC(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCC1=CC=C(C=C1)C(=O)CC(=O)C2=CC=C(C=C2)C(=O)OC(C)C

InChI

InChI=1S/C35H50O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-29-19-21-30(22-20-29)33(36)27-34(37)31-23-25-32(26-24-31)35(38)39-28(2)3/h19-26,28H,4-18,27H2,1-3H3