[2-(4-methoxyphenyl)-4-nitro-phenyl] N-methyl-N-(phenylmethyl)sulfamate

Systemtic Name: [2-(4-methoxyphenyl)-4-nitro-phenyl] N-methyl-N-(phenylmethyl)sulfamate Openeye Name: [2-(4-methoxyphenyl)-4-nitro-phenyl] N-benzyl-N-methyl-sulfamate CAS Name: N-methyl-N-(phenylmethyl)sulfamic acid [2-(4-methoxyphenyl)-4-nitrophenyl] ester IUPAC Name: [2-(4-methoxyphenyl)-4-nitrophenyl] N-benzyl-N-methylsulfamate Traditional Name: N-benzyl-N-methyl-sulfamic acid [2-(4-methoxyphenyl)-4-nitro-phenyl] ester Formula: C21H20N2O6S MolecularWeight: 428.4583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)S(=O)(=O)OC2=C(C=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)OC

Isomeric SMILES

CN(CC1=CC=CC=C1)S(=O)(=O)OC2=C(C=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H20N2O6S/c1-22(15-16-6-4-3-5-7-16)30(26,27)29-21-13-10-18(23(24)25)14-20(21)17-8-11-19(28-2)12-9-17/h3-14H,15H2,1-2H3