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

Systemtic Name: [2,2-diethyl-4-(3-methoxy-5-oxidanylidene-2H-pyrrol-1-yl)-6-nitro-3,4-dihydrochromen-3-yl] ethanoate Openeye Name: [2,2-diethyl-4-(3-methoxy-5-oxo-2H-pyrrol-1-yl)-6-nitro-chroman-3-yl] acetate CAS Name: acetic acid [2,2-diethyl-4-(3-methoxy-5-oxo-2H-pyrrol-1-yl)-6-nitro-3,4-dihydro-2H-1-benzopyran-3-yl] ester IUPAC Name: [2,2-diethyl-4-(3-methoxy-5-oxo-2H-pyrrol-1-yl)-6-nitro-3,4-dihydrochromen-3-yl] acetate Traditional Name: acetic acid [2,2-diethyl-4-(2-keto-4-methoxy-3-pyrrolin-1-yl)-6-nitro-chroman-3-yl] ester Formula: C20H24N2O7 MolecularWeight: 404.41376

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])N3CC(=CC3=O)OC)OC(=O)C)CC

Isomeric SMILES

CCC1(C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])N3CC(=CC3=O)OC)OC(=O)C)CC

InChI

InChI=1S/C20H24N2O7/c1-5-20(6-2)19(28-12(3)23)18(21-11-14(27-4)10-17(21)24)15-9-13(22(25)26)7-8-16(15)29-20/h7-10,18-19H,5-6,11H2,1-4H3