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

Systemtic Name: [6-cyano-2,2-dimethyl-4-[5-oxidanylidene-3-(1-phenylethoxy)-2H-pyrrol-1-yl]-3,4-dihydrochromen-3-yl] ethanoate Openeye Name: [6-cyano-2,2-dimethyl-4-[5-oxo-3-(1-phenylethoxy)-2H-pyrrol-1-yl]chroman-3-yl] acetate CAS Name: acetic acid [6-cyano-2,2-dimethyl-4-[5-oxo-3-(1-phenylethoxy)-2H-pyrrol-1-yl]-3,4-dihydro-2H-1-benzopyran-3-yl] ester IUPAC Name: [6-cyano-2,2-dimethyl-4-[5-oxo-3-(1-phenylethoxy)-2H-pyrrol-1-yl]-3,4-dihydrochromen-3-yl] acetate Traditional Name: acetic acid [6-cyano-4-[2-keto-4-(1-phenylethoxy)-3-pyrrolin-1-yl]-2,2-dimethyl-chroman-3-yl] ester Formula: C26H26N2O5 MolecularWeight: 446.49504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)OC2=CC(=O)N(C2)C3C(C(OC4=C3C=C(C=C4)C#N)(C)C)OC(=O)C

Isomeric SMILES

CC(C1=CC=CC=C1)OC2=CC(=O)N(C2)C3C(C(OC4=C3C=C(C=C4)C#N)(C)C)OC(=O)C

InChI

InChI=1S/C26H26N2O5/c1-16(19-8-6-5-7-9-19)31-20-13-23(30)28(15-20)24-21-12-18(14-27)10-11-22(21)33-26(3,4)25(24)32-17(2)29/h5-13,16,24-25H,15H2,1-4H3