1,3-dimethyl-5-(3-nitrophenyl)-6-(2-oxidanylpropan-2-yl)pyrrolo[3,4-d]pyrimidine-2,4-dione

Systemtic Name: 1,3-dimethyl-5-(3-nitrophenyl)-6-(2-oxidanylpropan-2-yl)pyrrolo[3,4-d]pyrimidine-2,4-dione Openeye Name: 6-(1-hydroxy-1-methyl-ethyl)-1,3-dimethyl-5-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione CAS Name: 6-(2-hydroxypropan-2-yl)-1,3-dimethyl-5-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione IUPAC Name: 6-(2-hydroxypropan-2-yl)-1,3-dimethyl-5-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione Traditional Name: 6-(1-hydroxy-1-methyl-ethyl)-1,3-dimethyl-5-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-quinone Formula: C17H18N4O5 MolecularWeight: 358.34862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(N1C=C2C(=C1C3=CC(=CC=C3)[N+](=O)[O-])C(=O)N(C(=O)N2C)C)O

Isomeric SMILES

CC(C)(N1C=C2C(=C1C3=CC(=CC=C3)[N+](=O)[O-])C(=O)N(C(=O)N2C)C)O

InChI

InChI=1S/C17H18N4O5/c1-17(2,24)20-9-12-13(15(22)19(4)16(23)18(12)3)14(20)10-6-5-7-11(8-10)21(25)26/h5-9,24H,1-4H3