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

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

CC(C)OC1=CC(=O)N(C1)C2C(C(OC3=C2C=C(C=C3)[N+](=O)[O-])(C)C)OC(=O)C

Isomeric SMILES

CC(C)OC1=CC(=O)N(C1)C2C(C(OC3=C2C=C(C=C3)[N+](=O)[O-])(C)C)OC(=O)C

InChI

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