2-[6-[2-(4-methylphenoxy)phenyl]azanidylsulfonyl-3-oxidanylidene-1,4-benzoxazin-4-yl]ethanoate

Systemtic Name: 2-[6-[2-(4-methylphenoxy)phenyl]azanidylsulfonyl-3-oxidanylidene-1,4-benzoxazin-4-yl]ethanoate Openeye Name: 2-[6-[2-(4-methylphenoxy)phenyl]azanidylsulfonyl-3-oxo-1,4-benzoxazin-4-yl]acetate CAS Name: 2-[6-[2-(4-methylphenoxy)phenyl]azanidylsulfonyl-3-oxo-1,4-benzoxazin-4-yl]acetate IUPAC Name: 2-[6-[2-(4-methylphenoxy)phenyl]azanidylsulfonyl-3-oxo-1,4-benzoxazin-4-yl]acetate Traditional Name: 2-[3-keto-6-[2-(4-methylphenoxy)phenyl]azanidylsulfonyl-1,4-benzoxazin-4-yl]acetate Formula: C23H18N2O7S-2 MolecularWeight: 466.46322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=CC=CC=C2[N-]S(=O)(=O)C3=CC4=C(C=C3)OCC(=O)N4CC(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)OC2=CC=CC=C2[N-]S(=O)(=O)C3=CC4=C(C=C3)OCC(=O)N4CC(=O)[O-]

InChI

InChI=1S/C23H19N2O7S/c1-15-6-8-16(9-7-15)32-20-5-3-2-4-18(20)24-33(29,30)17-10-11-21-19(12-17)25(13-23(27)28)22(26)14-31-21/h2-12H,13-14H2,1H3,(H,27,28)/q-1/p-1