(diphenylmethyl) 2-azanyl-6-oxidanylidene-3,7-dihydropurine-8-carboxylate

Systemtic Name: (diphenylmethyl) 2-azanyl-6-oxidanylidene-3,7-dihydropurine-8-carboxylate Openeye Name: benzhydryl 2-amino-6-oxo-3,7-dihydropurine-8-carboxylate CAS Name: 2-amino-6-oxo-3,7-dihydropurine-8-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 2-amino-6-oxo-3,7-dihydropurine-8-carboxylate Traditional Name: 2-amino-6-keto-3,7-dihydropurine-8-carboxylic acid benzhydryl ester Formula: C19H15N5O3 MolecularWeight: 361.3541

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)OC(=O)C3=NC4=C(N3)C(=O)N=C(N4)N

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)OC(=O)C3=NC4=C(N3)C(=O)N=C(N4)N

InChI

InChI=1S/C19H15N5O3/c20-19-23-15-13(17(25)24-19)21-16(22-15)18(26)27-14(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,14H,(H4,20,21,22,23,24,25)