7-(4-chlorophenyl)-2,4-dipropyl-8H-purino[7,8-a]pyrrole-1,3-dione

Systemtic Name: 7-(4-chlorophenyl)-2,4-dipropyl-8H-purino[7,8-a]pyrrole-1,3-dione Openeye Name: 7-(4-chlorophenyl)-2,4-dipropyl-8H-purino[7,8-a]pyrrole-1,3-dione CAS Name: 7-(4-chlorophenyl)-2,4-dipropyl-8H-purino[7,8-a]pyrrole-1,3-dione IUPAC Name: 7-(4-chlorophenyl)-2,4-dipropyl-8H-purino[7,8-a]pyrrole-1,3-dione Traditional Name: 7-(4-chlorophenyl)-2,4-dipropyl-8H-purino[7,8-a]pyrrole-1,3-quinone Formula: C20H21ClN4O2 MolecularWeight: 384.85934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CCC)N3CC(=CC3=N2)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CCC)N3CC(=CC3=N2)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H21ClN4O2/c1-3-9-23-18-17(19(26)24(10-4-2)20(23)27)25-12-14(11-16(25)22-18)13-5-7-15(21)8-6-13/h5-8,11H,3-4,9-10,12H2,1-2H3