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

Systemtic Name: [2,2-dibutyl-6-cyano-4-(3-methoxy-5-oxidanylidene-2H-pyrrol-1-yl)-3,4-dihydrochromen-3-yl] ethanoate Openeye Name: [2,2-dibutyl-6-cyano-4-(3-methoxy-5-oxo-2H-pyrrol-1-yl)chroman-3-yl] acetate CAS Name: acetic acid [2,2-dibutyl-6-cyano-4-(3-methoxy-5-oxo-2H-pyrrol-1-yl)-3,4-dihydro-2H-1-benzopyran-3-yl] ester IUPAC Name: [2,2-dibutyl-6-cyano-4-(3-methoxy-5-oxo-2H-pyrrol-1-yl)-3,4-dihydrochromen-3-yl] acetate Traditional Name: acetic acid [2,2-dibutyl-6-cyano-4-(2-keto-4-methoxy-3-pyrrolin-1-yl)chroman-3-yl] ester Formula: C25H32N2O5 MolecularWeight: 440.53198

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H32N2O5/c1-5-7-11-25(12-8-6-2)24(31-17(3)28)23(27-16-19(30-4)14-22(27)29)20-13-18(15-26)9-10-21(20)32-25/h9-10,13-14,23-24H,5-8,11-12,16H2,1-4H3