2-[[(4-benzamido-2,5-diethoxy-phenyl)diazenyl]-methyl-amino]ethanesulfonic acid

Systemtic Name: 2-[[(4-benzamido-2,5-diethoxy-phenyl)diazenyl]-methyl-amino]ethanesulfonic acid Openeye Name: 2-[(4-benzamido-2,5-diethoxy-phenyl)azo-methyl-amino]ethanesulfonic acid CAS Name: 2-[(4-benzamido-2,5-diethoxyphenyl)azo-methylamino]ethanesulfonic acid IUPAC Name: 2-[[(4-benzamido-2,5-diethoxyphenyl)diazenyl]-methylamino]ethanesulfonic acid Traditional Name: 2-[(4-benzamido-2,5-diethoxy-phenyl)azo-methyl-amino]ethanesulfonic acid Formula: C20H26N4O6S MolecularWeight: 450.50864

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1N=NN(C)CCS(=O)(=O)O)OCC)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC1=CC(=C(C=C1N=NN(C)CCS(=O)(=O)O)OCC)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H26N4O6S/c1-4-29-18-14-17(22-23-24(3)11-12-31(26,27)28)19(30-5-2)13-16(18)21-20(25)15-9-7-6-8-10-15/h6-10,13-14H,4-5,11-12H2,1-3H3,(H,21,25)(H,26,27,28)