5-(2-bromanyl-5-nitro-phenyl)-1,3-dimethyl-6-(1-naphthalen-1-ylethyl)pyrrolo[3,4-d]pyrimidine-2,4-dione

Systemtic Name: 5-(2-bromanyl-5-nitro-phenyl)-1,3-dimethyl-6-(1-naphthalen-1-ylethyl)pyrrolo[3,4-d]pyrimidine-2,4-dione Openeye Name: 5-(2-bromo-5-nitro-phenyl)-1,3-dimethyl-6-[1-(1-naphthyl)ethyl]pyrrolo[3,4-d]pyrimidine-2,4-dione CAS Name: 5-(2-bromo-5-nitrophenyl)-1,3-dimethyl-6-[1-(1-naphthalenyl)ethyl]pyrrolo[3,4-d]pyrimidine-2,4-dione IUPAC Name: 5-(2-bromo-5-nitrophenyl)-1,3-dimethyl-6-(1-naphthalen-1-ylethyl)pyrrolo[3,4-d]pyrimidine-2,4-dione Traditional Name: 5-(2-bromo-5-nitro-phenyl)-1,3-dimethyl-6-[1-(1-naphthyl)ethyl]pyrrolo[3,4-d]pyrimidine-2,4-quinone Formula: C26H21BrN4O4 MolecularWeight: 533.37334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)N3C=C4C(=C3C5=C(C=CC(=C5)[N+](=O)[O-])Br)C(=O)N(C(=O)N4C)C

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)N3C=C4C(=C3C5=C(C=CC(=C5)[N+](=O)[O-])Br)C(=O)N(C(=O)N4C)C

InChI

InChI=1S/C26H21BrN4O4/c1-15(18-10-6-8-16-7-4-5-9-19(16)18)30-14-22-23(25(32)29(3)26(33)28(22)2)24(30)20-13-17(31(34)35)11-12-21(20)27/h4-15H,1-3H3