sodium 2-[[(4-benzamido-2,5-dimethoxy-phenyl)diazenyl]-methyl-amino]ethanoate

Systemtic Name: sodium 2-[[(4-benzamido-2,5-dimethoxy-phenyl)diazenyl]-methyl-amino]ethanoate Openeye Name: sodium 2-[(4-benzamido-2,5-dimethoxy-phenyl)azo-methyl-amino]acetate CAS Name: sodium 2-[(4-benzamido-2,5-dimethoxyphenyl)azo-methylamino]acetate IUPAC Name: sodium 2-[[(4-benzamido-2,5-dimethoxyphenyl)diazenyl]-methylamino]acetate Traditional Name: sodium 2-[(4-benzamido-2,5-dimethoxy-phenyl)azo-methyl-amino]acetate Formula: C18H19N4NaO5 MolecularWeight: 394.35703

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)[O-])N=NC1=CC(=C(C=C1OC)NC(=O)C2=CC=CC=C2)OC.[Na+]

Isomeric SMILES

CN(CC(=O)[O-])N=NC1=CC(=C(C=C1OC)NC(=O)C2=CC=CC=C2)OC.[Na+]

InChI

InChI=1S/C18H20N4O5.Na/c1-22(11-17(23)24)21-20-14-10-15(26-2)13(9-16(14)27-3)19-18(25)12-7-5-4-6-8-12;/h4-10H,11H2,1-3H3,(H,19,25)(H,23,24);/q;+1/p-1