1-[3-(4-chloranyl-3,5-dimethyl-phenoxy)propyl]-8-methyl-3,1-benzoxazine-2,4-dione

Systemtic Name: 1-[3-(4-chloranyl-3,5-dimethyl-phenoxy)propyl]-8-methyl-3,1-benzoxazine-2,4-dione Openeye Name: 1-[3-(4-chloro-3,5-dimethyl-phenoxy)propyl]-8-methyl-3,1-benzoxazine-2,4-dione CAS Name: 1-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-8-methyl-3,1-benzoxazine-2,4-dione IUPAC Name: 1-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-8-methyl-3,1-benzoxazine-2,4-dione Traditional Name: 1-[3-(4-chloro-3,5-dimethyl-phenoxy)propyl]-8-methyl-3,1-benzoxazine-2,4-quinone Formula: C20H20ClNO4 MolecularWeight: 373.8301

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N(C(=O)OC2=O)CCCOC3=CC(=C(C(=C3)C)Cl)C

Isomeric SMILES

CC1=CC=CC2=C1N(C(=O)OC2=O)CCCOC3=CC(=C(C(=C3)C)Cl)C

InChI

InChI=1S/C20H20ClNO4/c1-12-6-4-7-16-18(12)22(20(24)26-19(16)23)8-5-9-25-15-10-13(2)17(21)14(3)11-15/h4,6-7,10-11H,5,8-9H2,1-3H3