4-(3-methyl-4-nitro-phenoxy)-1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-(3-methyl-4-nitro-phenoxy)-1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidine Openeye Name: 4-(3-methyl-4-nitro-phenoxy)-1-(m-tolyl)pyrazolo[3,4-d]pyrimidine CAS Name: 4-(3-methyl-4-nitrophenoxy)-1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidine IUPAC Name: 4-(3-methyl-4-nitrophenoxy)-1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidine Traditional Name: 4-(3-methyl-4-nitro-phenoxy)-1-(m-tolyl)pyrazolo[3,4-d]pyrimidine Formula: C19H15N5O3 MolecularWeight: 361.3541

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C3=C(C=N2)C(=NC=N3)OC4=CC(=C(C=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC=C1)N2C3=C(C=N2)C(=NC=N3)OC4=CC(=C(C=C4)[N+](=O)[O-])C

InChI

InChI=1S/C19H15N5O3/c1-12-4-3-5-14(8-12)23-18-16(10-22-23)19(21-11-20-18)27-15-6-7-17(24(25)26)13(2)9-15/h3-11H,1-2H3