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

Systemtic Name: [6-cyano-2,2-dimethyl-4-(5-oxidanylidene-3-propoxy-2H-pyrrol-1-yl)-3,4-dihydrochromen-3-yl] ethanoate Openeye Name: [6-cyano-2,2-dimethyl-4-(5-oxo-3-propoxy-2H-pyrrol-1-yl)chroman-3-yl] acetate CAS Name: acetic acid [6-cyano-2,2-dimethyl-4-(5-oxo-3-propoxy-2H-pyrrol-1-yl)-3,4-dihydro-2H-1-benzopyran-3-yl] ester IUPAC Name: [6-cyano-2,2-dimethyl-4-(5-oxo-3-propoxy-2H-pyrrol-1-yl)-3,4-dihydrochromen-3-yl] acetate Traditional Name: acetic acid [6-cyano-4-(2-keto-4-propoxy-3-pyrrolin-1-yl)-2,2-dimethyl-chroman-3-yl] ester Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=O)N(C1)C2C(C(OC3=C2C=C(C=C3)C#N)(C)C)OC(=O)C

Isomeric SMILES

CCCOC1=CC(=O)N(C1)C2C(C(OC3=C2C=C(C=C3)C#N)(C)C)OC(=O)C

InChI

InChI=1S/C21H24N2O5/c1-5-8-26-15-10-18(25)23(12-15)19-16-9-14(11-22)6-7-17(16)28-21(3,4)20(19)27-13(2)24/h6-7,9-10,19-20H,5,8,12H2,1-4H3