1-[3-(4-chloranyl-3,5-dimethyl-phenoxy)propyl]-6-methyl-3,1-benzoxazine-2,4-dione

Systemtic Name: 1-[3-(4-chloranyl-3,5-dimethyl-phenoxy)propyl]-6-methyl-3,1-benzoxazine-2,4-dione Openeye Name: 1-[3-(4-chloro-3,5-dimethyl-phenoxy)propyl]-6-methyl-3,1-benzoxazine-2,4-dione CAS Name: 1-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-6-methyl-3,1-benzoxazine-2,4-dione IUPAC Name: 1-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-6-methyl-3,1-benzoxazine-2,4-dione Traditional Name: 1-[3-(4-chloro-3,5-dimethyl-phenoxy)propyl]-6-methyl-3,1-benzoxazine-2,4-quinone Formula: C20H20ClNO4 MolecularWeight: 373.8301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)OC2=O)CCCOC3=CC(=C(C(=C3)C)Cl)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)OC2=O)CCCOC3=CC(=C(C(=C3)C)Cl)C

InChI

InChI=1S/C20H20ClNO4/c1-12-5-6-17-16(9-12)19(23)26-20(24)22(17)7-4-8-25-15-10-13(2)18(21)14(3)11-15/h5-6,9-11H,4,7-8H2,1-3H3