10,10-dimethyl-7-[1-(3-nitrophenyl)pyrrol-2-yl]-8-oxaspiro[5.5]undecane-9,11-dione

Systemtic Name: 10,10-dimethyl-7-[1-(3-nitrophenyl)pyrrol-2-yl]-8-oxaspiro[5.5]undecane-9,11-dione Openeye Name: 10,10-dimethyl-7-[1-(3-nitrophenyl)pyrrol-2-yl]-8-oxaspiro[5.5]undecane-9,11-dione CAS Name: 10,10-dimethyl-7-[1-(3-nitrophenyl)-2-pyrrolyl]-8-oxaspiro[5.5]undecane-9,11-dione IUPAC Name: 10,10-dimethyl-7-[1-(3-nitrophenyl)pyrrol-2-yl]-8-oxaspiro[5.5]undecane-9,11-dione Traditional Name: 10,10-dimethyl-7-[1-(3-nitrophenyl)pyrrol-2-yl]-8-oxaspiro[5.5]undecane-9,11-quinone Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C2(CCCCC2)C(OC1=O)C3=CC=CN3C4=CC(=CC=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1(C(=O)C2(CCCCC2)C(OC1=O)C3=CC=CN3C4=CC(=CC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C22H24N2O5/c1-21(2)19(25)22(11-4-3-5-12-22)18(29-20(21)26)17-10-7-13-23(17)15-8-6-9-16(14-15)24(27)28/h6-10,13-14,18H,3-5,11-12H2,1-2H3