1-(2,2-dimethyl-6-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl)-3-phenylmethoxy-2H-pyrrol-5-one

Systemtic Name: 1-(2,2-dimethyl-6-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl)-3-phenylmethoxy-2H-pyrrol-5-one Openeye Name: 3-benzyloxy-1-(3-hydroxy-2,2-dimethyl-6-nitro-chroman-4-yl)-2H-pyrrol-5-one CAS Name: 1-(3-hydroxy-2,2-dimethyl-6-nitro-3,4-dihydro-2H-1-benzopyran-4-yl)-3-phenylmethoxy-2H-pyrrol-5-one IUPAC Name: 1-(3-hydroxy-2,2-dimethyl-6-nitro-3,4-dihydrochromen-4-yl)-3-phenylmethoxy-2H-pyrrol-5-one Traditional Name: 4-benzoxy-1-(3-hydroxy-2,2-dimethyl-6-nitro-chroman-4-yl)-3-pyrrolin-2-one Formula: C22H22N2O6 MolecularWeight: 410.41988

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])N3CC(=CC3=O)OCC4=CC=CC=C4)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])N3CC(=CC3=O)OCC4=CC=CC=C4)O)C

InChI

InChI=1S/C22H22N2O6/c1-22(2)21(26)20(17-10-15(24(27)28)8-9-18(17)30-22)23-12-16(11-19(23)25)29-13-14-6-4-3-5-7-14/h3-11,20-21,26H,12-13H2,1-2H3