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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=O)N(C1)C2C(C(OC3=C2C=C(C=C3)[N+](=O)[O-])(C)C)OC(=O)C

Isomeric SMILES

CCCOC1=CC(=O)N(C1)C2C(C(OC3=C2C=C(C=C3)[N+](=O)[O-])(C)C)OC(=O)C

InChI

InChI=1S/C20H24N2O7/c1-5-8-27-14-10-17(24)21(11-14)18-15-9-13(22(25)26)6-7-16(15)29-20(3,4)19(18)28-12(2)23/h6-7,9-10,18-19H,5,8,11H2,1-4H3