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

Systemtic Name: [6-cyano-2,2-dimethyl-4-(5-oxidanylidene-3-phenoxy-2H-pyrrol-1-yl)-3,4-dihydrochromen-3-yl] ethanoate Openeye Name: [6-cyano-2,2-dimethyl-4-(5-oxo-3-phenoxy-2H-pyrrol-1-yl)chroman-3-yl] acetate CAS Name: acetic acid [6-cyano-2,2-dimethyl-4-(5-oxo-3-phenoxy-2H-pyrrol-1-yl)-3,4-dihydro-2H-1-benzopyran-3-yl] ester IUPAC Name: [6-cyano-2,2-dimethyl-4-(5-oxo-3-phenoxy-2H-pyrrol-1-yl)-3,4-dihydrochromen-3-yl] acetate Traditional Name: acetic acid [6-cyano-4-(2-keto-4-phenoxy-3-pyrrolin-1-yl)-2,2-dimethyl-chroman-3-yl] ester Formula: C24H22N2O5 MolecularWeight: 418.44188

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C2=C(C=CC(=C2)C#N)OC1(C)C)N3CC(=CC3=O)OC4=CC=CC=C4

Isomeric SMILES

CC(=O)OC1C(C2=C(C=CC(=C2)C#N)OC1(C)C)N3CC(=CC3=O)OC4=CC=CC=C4

InChI

InChI=1S/C24H22N2O5/c1-15(27)29-23-22(19-11-16(13-25)9-10-20(19)31-24(23,2)3)26-14-18(12-21(26)28)30-17-7-5-4-6-8-17/h4-12,22-23H,14H2,1-3H3