(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl (2S)-2-(butylsulfonylamino)propanoate

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl (2S)-2-(butylsulfonylamino)propanoate Openeye Name: (7-methoxy-2-oxo-chromen-4-yl)methyl (2S)-2-(butylsulfonylamino)propanoate CAS Name: (2S)-2-(butylsulfonylamino)propanoic acid (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methoxy-2-oxochromen-4-yl)methyl (2S)-2-(butylsulfonylamino)propanoate Traditional Name: (2S)-2-(butylsulfonylamino)propionic acid (2-keto-7-methoxy-chromen-4-yl)methyl ester Formula: C18H23NO7S MolecularWeight: 397.44272

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC(C)C(=O)OCC1=CC(=O)OC2=C1C=CC(=C2)OC

Isomeric SMILES

CCCCS(=O)(=O)N[C@@H](C)C(=O)OCC1=CC(=O)OC2=C1C=CC(=C2)OC

InChI

InChI=1S/C18H23NO7S/c1-4-5-8-27(22,23)19-12(2)18(21)25-11-13-9-17(20)26-16-10-14(24-3)6-7-15(13)16/h6-7,9-10,12,19H,4-5,8,11H2,1-3H3/t12-/m0/s1