(3-oxidanylidenebenzo[f]chromen-1-yl)methyl (2S)-2-(butylsulfonylamino)propanoate

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl (2S)-2-(butylsulfonylamino)propanoate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl (2S)-2-(butylsulfonylamino)propanoate CAS Name: (2S)-2-(butylsulfonylamino)propanoic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl (2S)-2-(butylsulfonylamino)propanoate Traditional Name: (2S)-2-(butylsulfonylamino)propionic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C21H23NO6S MolecularWeight: 417.47542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC(C)C(=O)OCC1=CC(=O)OC2=C1C3=CC=CC=C3C=C2

Isomeric SMILES

CCCCS(=O)(=O)N[C@@H](C)C(=O)OCC1=CC(=O)OC2=C1C3=CC=CC=C3C=C2

InChI

InChI=1S/C21H23NO6S/c1-3-4-11-29(25,26)22-14(2)21(24)27-13-16-12-19(23)28-18-10-9-15-7-5-6-8-17(15)20(16)18/h5-10,12,14,22H,3-4,11,13H2,1-2H3/t14-/m0/s1