6-[4-(aminomethyl)-4-(4-chlorophenyl)piperidin-1-yl]-7-ethyl-9H-purin-8-one

Systemtic Name: 6-[4-(aminomethyl)-4-(4-chlorophenyl)piperidin-1-yl]-7-ethyl-9H-purin-8-one Openeye Name: 6-[4-(aminomethyl)-4-(4-chlorophenyl)-1-piperidyl]-7-ethyl-9H-purin-8-one CAS Name: 6-[4-(aminomethyl)-4-(4-chlorophenyl)-1-piperidinyl]-7-ethyl-9H-purin-8-one IUPAC Name: 6-[4-(aminomethyl)-4-(4-chlorophenyl)piperidin-1-yl]-7-ethyl-9H-purin-8-one Traditional Name: 6-[4-(aminomethyl)-4-(4-chlorophenyl)piperidino]-7-ethyl-9H-purin-8-one Formula: C19H23ClN6O MolecularWeight: 386.87852

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(NC1=O)N=CN=C2N3CCC(CC3)(CN)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCN1C2=C(NC1=O)N=CN=C2N3CCC(CC3)(CN)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C19H23ClN6O/c1-2-26-15-16(24-18(26)27)22-12-23-17(15)25-9-7-19(11-21,8-10-25)13-3-5-14(20)6-4-13/h3-6,12H,2,7-11,21H2,1H3,(H,22,23,24,27)