3-chloranyl-4-(oxolan-2-ylmethylamino)-1-(4-phenoxyphenyl)pyrrole-2,5-dione

Systemtic Name: 3-chloranyl-4-(oxolan-2-ylmethylamino)-1-(4-phenoxyphenyl)pyrrole-2,5-dione Openeye Name: 3-chloro-1-(4-phenoxyphenyl)-4-(tetrahydrofuran-2-ylmethylamino)pyrrole-2,5-dione CAS Name: 3-chloro-4-(2-oxolanylmethylamino)-1-(4-phenoxyphenyl)pyrrole-2,5-dione IUPAC Name: 3-chloro-4-(oxolan-2-ylmethylamino)-1-(4-phenoxyphenyl)pyrrole-2,5-dione Traditional Name: 3-chloro-1-(4-phenoxyphenyl)-4-(tetrahydrofurfurylamino)-3-pyrroline-2,5-quinone Formula: C21H19ClN2O4 MolecularWeight: 398.83956

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC2=C(C(=O)N(C2=O)C3=CC=C(C=C3)OC4=CC=CC=C4)Cl

Isomeric SMILES

C1CC(OC1)CNC2=C(C(=O)N(C2=O)C3=CC=C(C=C3)OC4=CC=CC=C4)Cl

InChI

InChI=1S/C21H19ClN2O4/c22-18-19(23-13-17-7-4-12-27-17)21(26)24(20(18)25)14-8-10-16(11-9-14)28-15-5-2-1-3-6-15/h1-3,5-6,8-11,17,23H,4,7,12-13H2