5-[(2-chloranyl-5-methoxy-4-propoxy-phenyl)methylidene]-1,3-diphenethyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(2-chloranyl-5-methoxy-4-propoxy-phenyl)methylidene]-1,3-diphenethyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(2-chloro-5-methoxy-4-propoxy-phenyl)methylene]-1,3-diphenethyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(2-chloro-5-methoxy-4-propoxyphenyl)methylidene]-1,3-diphenethyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(2-chloro-5-methoxy-4-propoxyphenyl)methylidene]-1,3-diphenethyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-(2-chloro-5-methoxy-4-propoxy-benzylidene)-1,3-diphenethyl-barbituric acid Formula: C31H31ClN2O5 MolecularWeight: 547.04124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C(=C1)Cl)C=C2C(=O)N(C(=O)N(C2=O)CCC3=CC=CC=C3)CCC4=CC=CC=C4)OC

Isomeric SMILES

CCCOC1=C(C=C(C(=C1)Cl)C=C2C(=O)N(C(=O)N(C2=O)CCC3=CC=CC=C3)CCC4=CC=CC=C4)OC

InChI

InChI=1S/C31H31ClN2O5/c1-3-18-39-28-21-26(32)24(20-27(28)38-2)19-25-29(35)33(16-14-22-10-6-4-7-11-22)31(37)34(30(25)36)17-15-23-12-8-5-9-13-23/h4-13,19-21H,3,14-18H2,1-2H3