(7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 3-(phenylsulfonylamino)propanoate

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 3-(phenylsulfonylamino)propanoate Openeye Name: (7-ethyl-2-oxo-chromen-4-yl)methyl 3-(benzenesulfonamido)propanoate CAS Name: 3-(benzenesulfonamido)propanoic acid (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl 3-(benzenesulfonamido)propanoate Traditional Name: 3-(benzenesulfonamido)propionic acid (7-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C21H21NO6S MolecularWeight: 415.45954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCNS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCNS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H21NO6S/c1-2-15-8-9-18-16(13-21(24)28-19(18)12-15)14-27-20(23)10-11-22-29(25,26)17-6-4-3-5-7-17/h3-9,12-13,22H,2,10-11,14H2,1H3