methyl 2-[3-[(6-methyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)sulfonyl]propanoylamino]benzoate

Systemtic Name: methyl 2-[3-[(6-methyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)sulfonyl]propanoylamino]benzoate Openeye Name: methyl 2-[3-[(6-methyl-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl]propanoylamino]benzoate CAS Name: 2-[[3-[(6-methyl-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl]-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[3-[(6-methyl-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl]propanoylamino]benzoate Traditional Name: 2-[3-[(3-keto-6-methyl-4H-1,4-benzoxazin-7-yl)sulfonyl]propanoylamino]benzoic acid methyl ester Formula: C20H20N2O7S MolecularWeight: 432.447

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1S(=O)(=O)CCC(=O)NC3=CC=CC=C3C(=O)OC)OCC(=O)N2

Isomeric SMILES

CC1=CC2=C(C=C1S(=O)(=O)CCC(=O)NC3=CC=CC=C3C(=O)OC)OCC(=O)N2

InChI

InChI=1S/C20H20N2O7S/c1-12-9-15-16(29-11-19(24)22-15)10-17(12)30(26,27)8-7-18(23)21-14-6-4-3-5-13(14)20(25)28-2/h3-6,9-10H,7-8,11H2,1-2H3,(H,21,23)(H,22,24)