1-[2-ethanoyl-5-phenyl-6-[9-(phenylmethyl)purin-6-yl]-1,3-dihydroinden-2-yl]ethanone

Systemtic Name: 1-[2-ethanoyl-5-phenyl-6-[9-(phenylmethyl)purin-6-yl]-1,3-dihydroinden-2-yl]ethanone Openeye Name: 1-[2-acetyl-5-(9-benzylpurin-6-yl)-6-phenyl-indan-2-yl]ethanone CAS Name: 1-[2-acetyl-5-phenyl-6-[9-(phenylmethyl)-6-purinyl]-1,3-dihydroinden-2-yl]ethanone IUPAC Name: 1-[2-acetyl-5-(9-benzylpurin-6-yl)-6-phenyl-1,3-dihydroinden-2-yl]ethanone Traditional Name: 1-[2-acetyl-5-(9-benzylpurin-6-yl)-6-phenyl-indan-2-yl]ethanone Formula: C31H26N4O2 MolecularWeight: 486.56374

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(CC2=C(C1)C=C(C(=C2)C3=CC=CC=C3)C4=C5C(=NC=N4)N(C=N5)CC6=CC=CC=C6)C(=O)C

Isomeric SMILES

CC(=O)C1(CC2=C(C1)C=C(C(=C2)C3=CC=CC=C3)C4=C5C(=NC=N4)N(C=N5)CC6=CC=CC=C6)C(=O)C

InChI

InChI=1S/C31H26N4O2/c1-20(36)31(21(2)37)15-24-13-26(23-11-7-4-8-12-23)27(14-25(24)16-31)28-29-30(33-18-32-28)35(19-34-29)17-22-9-5-3-6-10-22/h3-14,18-19H,15-17H2,1-2H3