methyl 2-(4-ethoxy-4-oxidanylidene-butanoyl)-7-phenylmethoxy-8-propyl-3,4-dihydrochromene-2-carboxylate

Systemtic Name: methyl 2-(4-ethoxy-4-oxidanylidene-butanoyl)-7-phenylmethoxy-8-propyl-3,4-dihydrochromene-2-carboxylate Openeye Name: methyl 7-benzyloxy-2-(4-ethoxy-4-oxo-butanoyl)-8-propyl-chromane-2-carboxylate CAS Name: 2-(4-ethoxy-1,4-dioxobutyl)-7-phenylmethoxy-8-propyl-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid methyl ester IUPAC Name: methyl 2-(4-ethoxy-4-oxobutanoyl)-7-phenylmethoxy-8-propyl-3,4-dihydrochromene-2-carboxylate Traditional Name: 7-benzoxy-2-(4-ethoxy-4-keto-butanoyl)-8-propyl-chroman-2-carboxylic acid methyl ester Formula: C27H32O7 MolecularWeight: 468.53878

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1OC(CC2)(C(=O)CCC(=O)OCC)C(=O)OC)OCC3=CC=CC=C3

Isomeric SMILES

CCCC1=C(C=CC2=C1OC(CC2)(C(=O)CCC(=O)OCC)C(=O)OC)OCC3=CC=CC=C3

InChI

InChI=1S/C27H32O7/c1-4-9-21-22(33-18-19-10-7-6-8-11-19)13-12-20-16-17-27(26(30)31-3,34-25(20)21)23(28)14-15-24(29)32-5-2/h6-8,10-13H,4-5,9,14-18H2,1-3H3