heptyl 2-hexyl-3,4-dihydro-2H-chromene-6-carboxylate

Systemtic Name: heptyl 2-hexyl-3,4-dihydro-2H-chromene-6-carboxylate Openeye Name: heptyl 2-hexylchromane-6-carboxylate CAS Name: 2-hexyl-3,4-dihydro-2H-1-benzopyran-6-carboxylic acid heptyl ester IUPAC Name: heptyl 2-hexyl-3,4-dihydro-2H-chromene-6-carboxylate Traditional Name: 2-hexylchroman-6-carboxylic acid heptyl ester Formula: C23H36O3 MolecularWeight: 360.53014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C1=CC2=C(C=C1)OC(CC2)CCCCCC

Isomeric SMILES

CCCCCCCOC(=O)C1=CC2=C(C=C1)OC(CC2)CCCCCC

InChI

InChI=1S/C23H36O3/c1-3-5-7-9-11-17-25-23(24)20-14-16-22-19(18-20)13-15-21(26-22)12-10-8-6-4-2/h14,16,18,21H,3-13,15,17H2,1-2H3