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

Systemtic Name: 6-chloranyl-2-ethyl-4-[2-methoxy-5-(3-methyl-1,2-oxazol-5-yl)phenyl]sulfonyl-2,3-dihydro-1,4-benzoxazine Openeye Name: 6-chloro-2-ethyl-4-[2-methoxy-5-(3-methylisoxazol-5-yl)phenyl]sulfonyl-2,3-dihydro-1,4-benzoxazine CAS Name: 6-chloro-2-ethyl-4-[2-methoxy-5-(3-methyl-5-isoxazolyl)phenyl]sulfonyl-2,3-dihydro-1,4-benzoxazine IUPAC Name: 6-chloro-2-ethyl-4-[2-methoxy-5-(3-methyl-1,2-oxazol-5-yl)phenyl]sulfonyl-2,3-dihydro-1,4-benzoxazine Traditional Name: 6-chloro-2-ethyl-4-[2-methoxy-5-(3-methylisoxazol-5-yl)phenyl]sulfonyl-2,3-dihydro-1,4-benzoxazine Formula: C21H21ClN2O5S MolecularWeight: 448.91984

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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=CC(=NO4)C)OC

Isomeric SMILES

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

InChI

InChI=1S/C21H21ClN2O5S/c1-4-16-12-24(17-11-15(22)6-8-18(17)28-16)30(25,26)21-10-14(5-7-19(21)27-3)20-9-13(2)23-29-20/h5-11,16H,4,12H2,1-3H3