heptyl N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methyl-sulfinamoyl]-N-methyl-carbamate

Systemtic Name: heptyl N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methyl-sulfinamoyl]-N-methyl-carbamate Openeye Name: heptyl N-[(2,2-dimethyl-3H-benzofuran-7-yl)oxycarbonyl-methyl-sulfinamoyl]-N-methyl-carbamate CAS Name: N-[[(2,2-dimethyl-3H-benzofuran-7-yl)oxy-oxomethyl]-methylsulfinamoyl]-N-methylcarbamic acid heptyl ester IUPAC Name: heptyl N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylsulfinamoyl]-N-methylcarbamate Traditional Name: N-[(2,2-dimethylcoumaran-7-yl)oxycarbonyl-methyl-sulfinamoyl]-N-methyl-carbamic acid heptyl ester Formula: C21H32N2O6S MolecularWeight: 440.55358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)N(C)S(=O)N(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C

Isomeric SMILES

CCCCCCCOC(=O)N(C)S(=O)N(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C

InChI

InChI=1S/C21H32N2O6S/c1-6-7-8-9-10-14-27-19(24)22(4)30(26)23(5)20(25)28-17-13-11-12-16-15-21(2,3)29-18(16)17/h11-13H,6-10,14-15H2,1-5H3