tert-butyl N-[7-(methylsulfonylamino)-4-oxidanylidene-6-phenoxy-chromen-2-yl]carbamate

Systemtic Name: tert-butyl N-[7-(methylsulfonylamino)-4-oxidanylidene-6-phenoxy-chromen-2-yl]carbamate Openeye Name: tert-butyl N-[7-(methanesulfonamido)-4-oxo-6-phenoxy-chromen-2-yl]carbamate CAS Name: N-[7-(methanesulfonamido)-4-oxo-6-phenoxy-1-benzopyran-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[7-(methanesulfonamido)-4-oxo-6-phenoxychromen-2-yl]carbamate Traditional Name: N-[4-keto-7-(methanesulfonamido)-6-phenoxy-chromen-2-yl]carbamic acid tert-butyl ester Formula: C21H22N2O7S MolecularWeight: 446.47358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC(=O)C2=CC(=C(C=C2O1)NS(=O)(=O)C)OC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC(=O)C2=CC(=C(C=C2O1)NS(=O)(=O)C)OC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O7S/c1-21(2,3)30-20(25)22-19-12-16(24)14-10-18(28-13-8-6-5-7-9-13)15(11-17(14)29-19)23-31(4,26)27/h5-12,23H,1-4H3,(H,22,25)