[2-methoxy-4-[2-[2-methoxy-6-(3-methoxy-2-oxidanyl-5-propyl-phenyl)-4-propyl-phenoxy]-3-oxidanyl-propanoyl]phenyl] benzoate

Systemtic Name: [2-methoxy-4-[2-[2-methoxy-6-(3-methoxy-2-oxidanyl-5-propyl-phenyl)-4-propyl-phenoxy]-3-oxidanyl-propanoyl]phenyl] benzoate Openeye Name: [4-[3-hydroxy-2-[2-(2-hydroxy-3-methoxy-5-propyl-phenyl)-6-methoxy-4-propyl-phenoxy]propanoyl]-2-methoxy-phenyl] benzoate CAS Name: benzoic acid [4-[3-hydroxy-2-[2-(2-hydroxy-3-methoxy-5-propylphenyl)-6-methoxy-4-propylphenoxy]-1-oxopropyl]-2-methoxyphenyl] ester IUPAC Name: [4-[3-hydroxy-2-[2-(2-hydroxy-3-methoxy-5-propylphenyl)-6-methoxy-4-propylphenoxy]propanoyl]-2-methoxyphenyl] benzoate Traditional Name: benzoic acid [4-[3-hydroxy-2-[2-(2-hydroxy-3-methoxy-5-propyl-phenyl)-6-methoxy-4-propyl-phenoxy]propanoyl]-2-methoxy-phenyl] ester Formula: C37H40O9 MolecularWeight: 628.7081

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C(=C1)C2=CC(=CC(=C2OC(CO)C(=O)C3=CC(=C(C=C3)OC(=O)C4=CC=CC=C4)OC)OC)CCC)O)OC

Isomeric SMILES

CCCC1=CC(=C(C(=C1)C2=CC(=CC(=C2OC(CO)C(=O)C3=CC(=C(C=C3)OC(=O)C4=CC=CC=C4)OC)OC)CCC)O)OC

InChI

InChI=1S/C37H40O9/c1-6-11-23-17-27(35(40)31(19-23)43-4)28-18-24(12-7-2)20-32(44-5)36(28)45-33(22-38)34(39)26-15-16-29(30(21-26)42-3)46-37(41)25-13-9-8-10-14-25/h8-10,13-21,33,38,40H,6-7,11-12,22H2,1-5H3