methyl 3-chloranyl-4-[8-methoxy-8-oxidanylidene-1-[2-(5-phenylpentoxy)phenyl]octan-3-yl]oxy-benzoate

Systemtic Name: methyl 3-chloranyl-4-[8-methoxy-8-oxidanylidene-1-[2-(5-phenylpentoxy)phenyl]octan-3-yl]oxy-benzoate Openeye Name: methyl 3-chloro-4-[6-methoxy-6-oxo-1-[2-[2-(5-phenylpentoxy)phenyl]ethyl]hexoxy]benzoate CAS Name: 3-chloro-4-[8-methoxy-8-oxo-1-[2-(5-phenylpentoxy)phenyl]octan-3-yl]oxybenzoic acid methyl ester IUPAC Name: methyl 3-chloro-4-[8-methoxy-8-oxo-1-[2-(5-phenylpentoxy)phenyl]octan-3-yl]oxybenzoate Traditional Name: 3-chloro-4-[6-keto-6-methoxy-1-[2-[2-(5-phenylpentoxy)phenyl]ethyl]hexoxy]benzoic acid methyl ester Formula: C34H41ClO6 MolecularWeight: 581.13874

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCC(CCC1=CC=CC=C1OCCCCCC2=CC=CC=C2)OC3=C(C=C(C=C3)C(=O)OC)Cl

Isomeric SMILES

COC(=O)CCCCC(CCC1=CC=CC=C1OCCCCCC2=CC=CC=C2)OC3=C(C=C(C=C3)C(=O)OC)Cl

InChI

InChI=1S/C34H41ClO6/c1-38-33(36)19-11-9-17-29(41-32-23-21-28(25-30(32)35)34(37)39-2)22-20-27-16-8-10-18-31(27)40-24-12-4-7-15-26-13-5-3-6-14-26/h3,5-6,8,10,13-14,16,18,21,23,25,29H,4,7,9,11-12,15,17,19-20,22,24H2,1-2H3