1-[3-(2,6-dimethyl-4-propan-2-yl-phenoxy)phenyl]pyrrole-2,5-dione

Systemtic Name: 1-[3-(2,6-dimethyl-4-propan-2-yl-phenoxy)phenyl]pyrrole-2,5-dione Openeye Name: 1-[3-(4-isopropyl-2,6-dimethyl-phenoxy)phenyl]pyrrole-2,5-dione CAS Name: 1-[3-(2,6-dimethyl-4-propan-2-ylphenoxy)phenyl]pyrrole-2,5-dione IUPAC Name: 1-[3-(2,6-dimethyl-4-propan-2-ylphenoxy)phenyl]pyrrole-2,5-dione Traditional Name: 1-[3-(4-isopropyl-2,6-dimethyl-phenoxy)phenyl]-3-pyrroline-2,5-quinone Formula: C21H21NO3 MolecularWeight: 335.39634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC2=CC=CC(=C2)N3C(=O)C=CC3=O)C)C(C)C

Isomeric SMILES

CC1=CC(=CC(=C1OC2=CC=CC(=C2)N3C(=O)C=CC3=O)C)C(C)C

InChI

InChI=1S/C21H21NO3/c1-13(2)16-10-14(3)21(15(4)11-16)25-18-7-5-6-17(12-18)22-19(23)8-9-20(22)24/h5-13H,1-4H3