[3-(heptanoyloxymethyl)-2-methoxy-4-oxidanyl-5-(phenylcarbonyl)phenyl]methyl heptanoate

Systemtic Name: [3-(heptanoyloxymethyl)-2-methoxy-4-oxidanyl-5-(phenylcarbonyl)phenyl]methyl heptanoate Openeye Name: [5-benzoyl-3-(heptanoyloxymethyl)-4-hydroxy-2-methoxy-phenyl]methyl heptanoate CAS Name: heptanoic acid [5-benzoyl-4-hydroxy-2-methoxy-3-(1-oxoheptoxymethyl)phenyl]methyl ester IUPAC Name: [5-benzoyl-3-(heptanoyloxymethyl)-4-hydroxy-2-methoxyphenyl]methyl heptanoate Traditional Name: enanthic acid [5-benzoyl-3-(enanthyloxymethyl)-4-hydroxy-2-methoxy-benzyl] ester Formula: C30H40O7 MolecularWeight: 512.6344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)OCC1=C(C(=C(C(=C1)C(=O)C2=CC=CC=C2)O)COC(=O)CCCCCC)OC

Isomeric SMILES

CCCCCCC(=O)OCC1=C(C(=C(C(=C1)C(=O)C2=CC=CC=C2)O)COC(=O)CCCCCC)OC

InChI

InChI=1S/C30H40O7/c1-4-6-8-13-17-26(31)36-20-23-19-24(28(33)22-15-11-10-12-16-22)29(34)25(30(23)35-3)21-37-27(32)18-14-9-7-5-2/h10-12,15-16,19,34H,4-9,13-14,17-18,20-21H2,1-3H3