2-(2-ethoxyphenyl)-9-(pyrrolidin-1-ylmethyl)-1H-purino[9,8-a]pyridin-4-one

Systemtic Name: 2-(2-ethoxyphenyl)-9-(pyrrolidin-1-ylmethyl)-1H-purino[9,8-a]pyridin-4-one Openeye Name: 2-(2-ethoxyphenyl)-9-(pyrrolidin-1-ylmethyl)-1H-purino[9,8-a]pyridin-4-one CAS Name: 2-(2-ethoxyphenyl)-9-(1-pyrrolidinylmethyl)-1H-purino[9,8-a]pyridin-4-one IUPAC Name: 2-(2-ethoxyphenyl)-9-(pyrrolidin-1-ylmethyl)-1H-purino[9,8-a]pyridin-4-one Traditional Name: 2-o-phenetyl-9-(pyrrolidinomethyl)-1H-purino[9,8-a]pyridin-4-one Formula: C22H23N5O2 MolecularWeight: 389.45032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2=NC(=O)C3=C(N2)N4C(=N3)C=CC=C4CN5CCCC5

Isomeric SMILES

CCOC1=CC=CC=C1C2=NC(=O)C3=C(N2)N4C(=N3)C=CC=C4CN5CCCC5

InChI

InChI=1S/C22H23N5O2/c1-2-29-17-10-4-3-9-16(17)20-24-21-19(22(28)25-20)23-18-11-7-8-15(27(18)21)14-26-12-5-6-13-26/h3-4,7-11H,2,5-6,12-14H2,1H3,(H,24,25,28)