methyl 4-[7-(methylsulfonylamino)-4-oxidanylidene-3-propyl-chromen-2-yl]benzoate

Systemtic Name: methyl 4-[7-(methylsulfonylamino)-4-oxidanylidene-3-propyl-chromen-2-yl]benzoate Openeye Name: methyl 4-[7-(methanesulfonamido)-4-oxo-3-propyl-chromen-2-yl]benzoate CAS Name: 4-[7-(methanesulfonamido)-4-oxo-3-propyl-1-benzopyran-2-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[7-(methanesulfonamido)-4-oxo-3-propylchromen-2-yl]benzoate Traditional Name: 4-[4-keto-7-(methanesulfonamido)-3-propyl-chromen-2-yl]benzoic acid methyl ester Formula: C21H21NO6S MolecularWeight: 415.45954

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(OC2=C(C1=O)C=CC(=C2)NS(=O)(=O)C)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCCC1=C(OC2=C(C1=O)C=CC(=C2)NS(=O)(=O)C)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C21H21NO6S/c1-4-5-17-19(23)16-11-10-15(22-29(3,25)26)12-18(16)28-20(17)13-6-8-14(9-7-13)21(24)27-2/h6-12,22H,4-5H2,1-3H3