(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(4-fluorophenyl)sulfonyl-methyl-amino]ethanoate

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(4-fluorophenyl)sulfonyl-methyl-amino]ethanoate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl 2-[(4-fluorophenyl)sulfonyl-methyl-amino]acetate CAS Name: 2-[(4-fluorophenyl)sulfonyl-methylamino]acetic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl 2-[(4-fluorophenyl)sulfonyl-methylamino]acetate Traditional Name: 2-[(4-fluorophenyl)sulfonyl-methyl-amino]acetic acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C21H20FNO6S MolecularWeight: 433.450003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)CN(C)S(=O)(=O)C3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)CN(C)S(=O)(=O)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C21H20FNO6S/c1-13-8-18-15(10-20(24)29-19(18)9-14(13)2)12-28-21(25)11-23(3)30(26,27)17-6-4-16(22)5-7-17/h4-10H,11-12H2,1-3H3