[3-methoxy-5-(2-oxidanylidenenonyl)-4-phenylmethoxycarbonyl-phenyl] 4-methoxy-2-oxidanyl-6-(2-oxidanylideneheptyl)benzoate

Systemtic Name: [3-methoxy-5-(2-oxidanylidenenonyl)-4-phenylmethoxycarbonyl-phenyl] 4-methoxy-2-oxidanyl-6-(2-oxidanylideneheptyl)benzoate Openeye Name: [4-benzyloxycarbonyl-3-methoxy-5-(2-oxononyl)phenyl] 2-hydroxy-4-methoxy-6-(2-oxoheptyl)benzoate CAS Name: 2-hydroxy-4-methoxy-6-(2-oxoheptyl)benzoic acid [3-methoxy-5-(2-oxononyl)-4-phenylmethoxycarbonylphenyl] ester IUPAC Name: [3-methoxy-5-(2-oxononyl)-4-phenylmethoxycarbonylphenyl] 2-hydroxy-4-methoxy-6-(2-oxoheptyl)benzoate Traditional Name: 2-hydroxy-6-(2-ketoheptyl)-4-methoxy-benzoic acid [4-carbobenzoxy-3-(2-ketononyl)-5-methoxy-phenyl] ester Formula: C39H48O9 MolecularWeight: 660.79302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)CC1=CC(=CC(=C1C(=O)OCC2=CC=CC=C2)OC)OC(=O)C3=C(C=C(C=C3CC(=O)CCCCC)OC)O

Isomeric SMILES

CCCCCCCC(=O)CC1=CC(=CC(=C1C(=O)OCC2=CC=CC=C2)OC)OC(=O)C3=C(C=C(C=C3CC(=O)CCCCC)OC)O

InChI

InChI=1S/C39H48O9/c1-5-7-9-10-15-19-31(41)21-29-23-33(25-35(46-4)37(29)38(43)47-26-27-16-13-11-14-17-27)48-39(44)36-28(20-30(40)18-12-8-6-2)22-32(45-3)24-34(36)42/h11,13-14,16-17,22-25,42H,5-10,12,15,18-21,26H2,1-4H3