(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl (2S)-2-(butylsulfonylamino)propanoate

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl (2S)-2-(butylsulfonylamino)propanoate Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl (2S)-2-(butylsulfonylamino)propanoate CAS Name: (2S)-2-(butylsulfonylamino)propanoic acid (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl (2S)-2-(butylsulfonylamino)propanoate Traditional Name: (2S)-2-(butylsulfonylamino)propionic acid (2-keto-7,8-dimethyl-chromen-4-yl)methyl ester Formula: C19H25NO6S MolecularWeight: 395.4699

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC(C)C(=O)OCC1=CC(=O)OC2=C1C=CC(=C2C)C

Isomeric SMILES

CCCCS(=O)(=O)N[C@@H](C)C(=O)OCC1=CC(=O)OC2=C1C=CC(=C2C)C

InChI

InChI=1S/C19H25NO6S/c1-5-6-9-27(23,24)20-14(4)19(22)25-11-15-10-17(21)26-18-13(3)12(2)7-8-16(15)18/h7-8,10,14,20H,5-6,9,11H2,1-4H3/t14-/m0/s1