6-chloranyl-4-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methyl-phenyl]sulfonyl-2-ethyl-2,3-dihydro-1,4-benzoxazine

Systemtic Name: 6-chloranyl-4-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methyl-phenyl]sulfonyl-2-ethyl-2,3-dihydro-1,4-benzoxazine Openeye Name: 6-chloro-4-[5-(3,4-dimethylisoxazol-5-yl)-2-methyl-phenyl]sulfonyl-2-ethyl-2,3-dihydro-1,4-benzoxazine CAS Name: 6-chloro-4-[5-(3,4-dimethyl-5-isoxazolyl)-2-methylphenyl]sulfonyl-2-ethyl-2,3-dihydro-1,4-benzoxazine IUPAC Name: 6-chloro-4-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylphenyl]sulfonyl-2-ethyl-2,3-dihydro-1,4-benzoxazine Traditional Name: 6-chloro-4-[5-(3,4-dimethylisoxazol-5-yl)-2-methyl-phenyl]sulfonyl-2-ethyl-2,3-dihydro-1,4-benzoxazine Formula: C22H23ClN2O4S MolecularWeight: 446.94702

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(C2=C(O1)C=CC(=C2)Cl)S(=O)(=O)C3=C(C=CC(=C3)C4=C(C(=NO4)C)C)C

Isomeric SMILES

CCC1CN(C2=C(O1)C=CC(=C2)Cl)S(=O)(=O)C3=C(C=CC(=C3)C4=C(C(=NO4)C)C)C

InChI

InChI=1S/C22H23ClN2O4S/c1-5-18-12-25(19-11-17(23)8-9-20(19)28-18)30(26,27)21-10-16(7-6-13(21)2)22-14(3)15(4)24-29-22/h6-11,18H,5,12H2,1-4H3