2-[[(4-methoxyphenyl)-diphenyl-methyl]amino]-9-[4-[(triphenylmethyl)oxymethyl]cyclohex-3-en-1-yl]-3H-purin-6-one

Systemtic Name: 2-[[(4-methoxyphenyl)-diphenyl-methyl]amino]-9-[4-[(triphenylmethyl)oxymethyl]cyclohex-3-en-1-yl]-3H-purin-6-one Openeye Name: 2-[[(4-methoxyphenyl)-diphenyl-methyl]amino]-9-[4-(trityloxymethyl)cyclohex-3-en-1-yl]-3H-purin-6-one CAS Name: 2-[[(4-methoxyphenyl)-diphenylmethyl]amino]-9-[4-[(triphenylmethyl)oxymethyl]-1-cyclohex-3-enyl]-3H-purin-6-one IUPAC Name: 2-[[(4-methoxyphenyl)-diphenylmethyl]amino]-9-[4-(trityloxymethyl)cyclohex-3-en-1-yl]-3H-purin-6-one Traditional Name: 2-[[(4-methoxyphenyl)-diphenyl-methyl]amino]-9-[4-(trityloxymethyl)cyclohex-3-en-1-yl]-3H-purin-6-one Formula: C51H45N5O3 MolecularWeight: 775.9347

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NC4=NC(=O)C5=C(N4)N(C=N5)C6CCC(=CC6)COC(C7=CC=CC=C7)(C8=CC=CC=C8)C9=CC=CC=C9

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NC4=NC(=O)C5=C(N4)N(C=N5)C6CCC(=CC6)COC(C7=CC=CC=C7)(C8=CC=CC=C8)C9=CC=CC=C9

InChI

InChI=1S/C51H45N5O3/c1-58-45-33-29-40(30-34-45)50(38-17-7-2-8-18-38,39-19-9-3-10-20-39)55-49-53-47-46(48(57)54-49)52-36-56(47)44-31-27-37(28-32-44)35-59-51(41-21-11-4-12-22-41,42-23-13-5-14-24-42)43-25-15-6-16-26-43/h2-27,29-30,33-34,36,44H,28,31-32,35H2,1H3,(H2,53,54,55,57)