[3-[(4E)-4-[bis(azanyl)methylidenehydrazinylidene]butoxy]-5-methyl-phenyl] 2-methoxybenzenesulfonate

Systemtic Name: [3-[(4E)-4-[bis(azanyl)methylidenehydrazinylidene]butoxy]-5-methyl-phenyl] 2-methoxybenzenesulfonate Openeye Name: [3-[(4E)-4-(diaminomethylenehydrazono)butoxy]-5-methyl-phenyl] 2-methoxybenzenesulfonate CAS Name: 2-methoxybenzenesulfonic acid [3-[(4E)-4-(diaminomethylidenehydrazinylidene)butoxy]-5-methylphenyl] ester IUPAC Name: [3-[(4E)-4-(diaminomethylidenehydrazinylidene)butoxy]-5-methylphenyl] 2-methoxybenzenesulfonate Traditional Name: 2-methoxybenzenesulfonic acid [3-[(4E)-4-(diaminomethylenehydrazono)butoxy]-5-methyl-phenyl] ester Formula: C19H24N4O5S MolecularWeight: 420.48266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OS(=O)(=O)C2=CC=CC=C2OC)OCCCC=NN=C(N)N

Isomeric SMILES

CC1=CC(=CC(=C1)OS(=O)(=O)C2=CC=CC=C2OC)OCCC/C=N/N=C(N)N

InChI

InChI=1S/C19H24N4O5S/c1-14-11-15(27-10-6-5-9-22-23-19(20)21)13-16(12-14)28-29(24,25)18-8-4-3-7-17(18)26-2/h3-4,7-9,11-13H,5-6,10H2,1-2H3,(H4,20,21,23)/b22-9+