4-methyl-6-nitro-1-(phenylmethyl)imidazo[1,2-a]purin-9-one

Systemtic Name: 4-methyl-6-nitro-1-(phenylmethyl)imidazo[1,2-a]purin-9-one Openeye Name: 1-benzyl-4-methyl-6-nitro-imidazo[1,2-a]purin-9-one CAS Name: 4-methyl-6-nitro-1-(phenylmethyl)-9-imidazo[1,2-a]purinone IUPAC Name: 1-benzyl-4-methyl-6-nitroimidazo[1,2-a]purin-9-one Traditional Name: 1-benzyl-4-methyl-6-nitro-imidazo[1,2-a]purin-9-one Formula: C15H12N6O3 MolecularWeight: 324.29418

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N3C1=NC(=C3)[N+](=O)[O-])N(C=N2)CC4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C(=O)N3C1=NC(=C3)[N+](=O)[O-])N(C=N2)CC4=CC=CC=C4

InChI

InChI=1S/C15H12N6O3/c1-18-13-12(14(22)20-8-11(21(23)24)17-15(18)20)19(9-16-13)7-10-5-3-2-4-6-10/h2-6,8-9H,7H2,1H3