[8-methanoyl-5-methoxy-2-methyl-2-(4-methyl-2-oxidanylidene-pent-3-enyl)-3,4-dihydrochromen-7-yl]methyl octadecanoate

Systemtic Name: [8-methanoyl-5-methoxy-2-methyl-2-(4-methyl-2-oxidanylidene-pent-3-enyl)-3,4-dihydrochromen-7-yl]methyl octadecanoate Openeye Name: [8-formyl-5-methoxy-2-methyl-2-(4-methyl-2-oxo-pent-3-enyl)chroman-7-yl]methyl octadecanoate CAS Name: octadecanoic acid [8-formyl-5-methoxy-2-methyl-2-(4-methyl-2-oxopent-3-enyl)-3,4-dihydro-2H-1-benzopyran-7-yl]methyl ester IUPAC Name: [8-formyl-5-methoxy-2-methyl-2-(4-methyl-2-oxopent-3-enyl)-3,4-dihydrochromen-7-yl]methyl octadecanoate Traditional Name: stearic acid [8-formyl-2-(2-keto-4-methyl-pent-3-enyl)-5-methoxy-2-methyl-chroman-7-yl]methyl ester Formula: C37H58O6 MolecularWeight: 598.85282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC1=CC(=C2CCC(OC2=C1C=O)(C)CC(=O)C=C(C)C)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC1=CC(=C2CCC(OC2=C1C=O)(C)CC(=O)C=C(C)C)OC

InChI

InChI=1S/C37H58O6/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-35(40)42-28-30-25-34(41-5)32-22-23-37(4,26-31(39)24-29(2)3)43-36(32)33(30)27-38/h24-25,27H,6-23,26,28H2,1-5H3