2-[[[2-methoxy-5-(phenylcarbamoyl)phenyl]diazenyl]-methyl-amino]ethanesulfonic acid

Systemtic Name: 2-[[[2-methoxy-5-(phenylcarbamoyl)phenyl]diazenyl]-methyl-amino]ethanesulfonic acid Openeye Name: 2-[[2-methoxy-5-(phenylcarbamoyl)phenyl]azo-methyl-amino]ethanesulfonic acid CAS Name: 2-[[5-[anilino(oxo)methyl]-2-methoxyphenyl]azo-methylamino]ethanesulfonic acid IUPAC Name: 2-[[[2-methoxy-5-(phenylcarbamoyl)phenyl]diazenyl]-methylamino]ethanesulfonic acid Traditional Name: 2-[[2-methoxy-5-(phenylcarbamoyl)phenyl]azo-methyl-amino]ethanesulfonic acid Formula: C17H20N4O5S MolecularWeight: 392.4295

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCS(=O)(=O)O)N=NC1=C(C=CC(=C1)C(=O)NC2=CC=CC=C2)OC

Isomeric SMILES

CN(CCS(=O)(=O)O)N=NC1=C(C=CC(=C1)C(=O)NC2=CC=CC=C2)OC

InChI

InChI=1S/C17H20N4O5S/c1-21(10-11-27(23,24)25)20-19-15-12-13(8-9-16(15)26-2)17(22)18-14-6-4-3-5-7-14/h3-9,12H,10-11H2,1-2H3,(H,18,22)(H,23,24,25)