8-(4-chloranyl-2-methoxy-phenyl)-1,3-dipropyl-7H-purine-2,6-dione

Systemtic Name: 8-(4-chloranyl-2-methoxy-phenyl)-1,3-dipropyl-7H-purine-2,6-dione Openeye Name: 8-(4-chloro-2-methoxy-phenyl)-1,3-dipropyl-7H-purine-2,6-dione CAS Name: 8-(4-chloro-2-methoxyphenyl)-1,3-dipropyl-7H-purine-2,6-dione IUPAC Name: 8-(4-chloro-2-methoxyphenyl)-1,3-dipropyl-7H-purine-2,6-dione Traditional Name: 8-(4-chloro-2-methoxy-phenyl)-1,3-dipropyl-7H-purine-2,6-quinone Formula: C18H21ClN4O3 MolecularWeight: 376.83734

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3=C(C=C(C=C3)Cl)OC

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3=C(C=C(C=C3)Cl)OC

InChI

InChI=1S/C18H21ClN4O3/c1-4-8-22-16-14(17(24)23(9-5-2)18(22)25)20-15(21-16)12-7-6-11(19)10-13(12)26-3/h6-7,10H,4-5,8-9H2,1-3H3,(H,20,21)