6-chloranyl-9-methyl-8-(4-methylphenyl)-7-[(4-nitrophenyl)methyl]-8H-purine

Systemtic Name: 6-chloranyl-9-methyl-8-(4-methylphenyl)-7-[(4-nitrophenyl)methyl]-8H-purine Openeye Name: 6-chloro-9-methyl-7-[(4-nitrophenyl)methyl]-8-(p-tolyl)-8H-purine CAS Name: 6-chloro-9-methyl-8-(4-methylphenyl)-7-[(4-nitrophenyl)methyl]-8H-purine IUPAC Name: 6-chloro-9-methyl-8-(4-methylphenyl)-7-[(4-nitrophenyl)methyl]-8H-purine Traditional Name: 6-chloro-9-methyl-7-(4-nitrobenzyl)-8-(p-tolyl)-8H-purine Formula: C20H18ClN5O2 MolecularWeight: 395.84222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2N(C3=C(N2CC4=CC=C(C=C4)[N+](=O)[O-])C(=NC=N3)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)C2N(C3=C(N2CC4=CC=C(C=C4)[N+](=O)[O-])C(=NC=N3)Cl)C

InChI

InChI=1S/C20H18ClN5O2/c1-13-3-7-15(8-4-13)20-24(2)19-17(18(21)22-12-23-19)25(20)11-14-5-9-16(10-6-14)26(27)28/h3-10,12,20H,11H2,1-2H3