8-[2-oxidanylidene-3-(6-oxidanylidene-3H-purin-9-yl)propyl]-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one

Systemtic Name: 8-[2-oxidanylidene-3-(6-oxidanylidene-3H-purin-9-yl)propyl]-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one Openeye Name: 8-[2-oxo-3-(6-oxo-3H-purin-9-yl)propyl]-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one CAS Name: 8-[2-oxo-3-(6-oxo-3H-purin-9-yl)propyl]-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one IUPAC Name: 8-[2-oxo-3-(6-oxo-3H-purin-9-yl)propyl]-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one Traditional Name: 8-[2-keto-3-(6-keto-3H-purin-9-yl)propyl]-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one Formula: C21H23N7O3 MolecularWeight: 421.45242

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12C(=O)NCN2C3=CC=CC=C3)CC(=O)CN4C=NC5=C4NC=NC5=O

Isomeric SMILES

C1CN(CCC12C(=O)NCN2C3=CC=CC=C3)CC(=O)CN4C=NC5=C4NC=NC5=O

InChI

InChI=1S/C21H23N7O3/c29-16(11-27-13-24-17-18(27)22-12-23-19(17)30)10-26-8-6-21(7-9-26)20(31)25-14-28(21)15-4-2-1-3-5-15/h1-5,12-13H,6-11,14H2,(H,25,31)(H,22,23,30)