[2,2-dibutyl-6-cyano-4-(3-ethoxy-5-oxidanylidene-2H-pyrrol-1-yl)-3,4-dihydrochromen-3-yl] ethanoate

Systemtic Name: [2,2-dibutyl-6-cyano-4-(3-ethoxy-5-oxidanylidene-2H-pyrrol-1-yl)-3,4-dihydrochromen-3-yl] ethanoate Openeye Name: [2,2-dibutyl-6-cyano-4-(3-ethoxy-5-oxo-2H-pyrrol-1-yl)chroman-3-yl] acetate CAS Name: acetic acid [2,2-dibutyl-6-cyano-4-(3-ethoxy-5-oxo-2H-pyrrol-1-yl)-3,4-dihydro-2H-1-benzopyran-3-yl] ester IUPAC Name: [2,2-dibutyl-6-cyano-4-(3-ethoxy-5-oxo-2H-pyrrol-1-yl)-3,4-dihydrochromen-3-yl] acetate Traditional Name: acetic acid [2,2-dibutyl-6-cyano-4-(4-ethoxy-2-keto-3-pyrrolin-1-yl)chroman-3-yl] ester Formula: C26H34N2O5 MolecularWeight: 454.55856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(C(C2=C(O1)C=CC(=C2)C#N)N3CC(=CC3=O)OCC)OC(=O)C)CCCC

Isomeric SMILES

CCCCC1(C(C(C2=C(O1)C=CC(=C2)C#N)N3CC(=CC3=O)OCC)OC(=O)C)CCCC

InChI

InChI=1S/C26H34N2O5/c1-5-8-12-26(13-9-6-2)25(32-18(4)29)24(28-17-20(31-7-3)15-23(28)30)21-14-19(16-27)10-11-22(21)33-26/h10-11,14-15,24-25H,5-9,12-13,17H2,1-4H3