4-[[(4-methoxyphenyl)sulfonyl-(pyridin-4-ylmethyl)amino]methyl]-N-oxidanidyl-benzamide

Systemtic Name: 4-[[(4-methoxyphenyl)sulfonyl-(pyridin-4-ylmethyl)amino]methyl]-N-oxidanidyl-benzamide Openeye Name: 4-[[(4-methoxyphenyl)sulfonyl-(4-pyridylmethyl)amino]methyl]-N-oxido-benzamide CAS Name: 4-[[(4-methoxyphenyl)sulfonyl-(pyridin-4-ylmethyl)amino]methyl]-N-oxidobenzamide IUPAC Name: 4-[[(4-methoxyphenyl)sulfonyl-(pyridin-4-ylmethyl)amino]methyl]-N-oxidobenzamide Traditional Name: 4-[[(4-methoxyphenyl)sulfonyl-(4-pyridylmethyl)amino]methyl]-N-oxido-benzamide Formula: C21H20N3O5S- MolecularWeight: 426.4656

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)C(=O)N[O-])CC3=CC=NC=C3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)C(=O)N[O-])CC3=CC=NC=C3

InChI

InChI=1S/C21H20N3O5S/c1-29-19-6-8-20(9-7-19)30(27,28)24(15-17-10-12-22-13-11-17)14-16-2-4-18(5-3-16)21(25)23-26/h2-13H,14-15H2,1H3,(H-,23,25,26)/q-1