2-[(2,4-dimethoxyphenyl)methyl]-1-(4-methyl-3-nitro-phenyl)sulfonyl-guanidine

Systemtic Name: 2-[(2,4-dimethoxyphenyl)methyl]-1-(4-methyl-3-nitro-phenyl)sulfonyl-guanidine Openeye Name: 2-[(2,4-dimethoxyphenyl)methyl]-1-(4-methyl-3-nitro-phenyl)sulfonyl-guanidine CAS Name: 2-[(2,4-dimethoxyphenyl)methyl]-1-(4-methyl-3-nitrophenyl)sulfonylguanidine IUPAC Name: 2-[(2,4-dimethoxyphenyl)methyl]-1-(4-methyl-3-nitrophenyl)sulfonylguanidine Traditional Name: 2-(2,4-dimethoxybenzyl)-1-(4-methyl-3-nitro-phenyl)sulfonyl-guanidine Formula: C17H20N4O6S MolecularWeight: 408.4289

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC(=NCC2=C(C=C(C=C2)OC)OC)N)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC(=NCC2=C(C=C(C=C2)OC)OC)N)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O6S/c1-11-4-7-14(9-15(11)21(22)23)28(24,25)20-17(18)19-10-12-5-6-13(26-2)8-16(12)27-3/h4-9H,10H2,1-3H3,(H3,18,19,20)