sodium 4-[[4-[4-(prop-2-enoylamino)butoxy]phenyl]diazenyl]benzenesulfonate

Systemtic Name: sodium 4-[[4-[4-(prop-2-enoylamino)butoxy]phenyl]diazenyl]benzenesulfonate Openeye Name: sodium 4-[4-[4-(prop-2-enoylamino)butoxy]phenyl]azobenzenesulfonate CAS Name: sodium 4-[4-[4-(1-oxoprop-2-enylamino)butoxy]phenyl]azobenzenesulfonate IUPAC Name: sodium 4-[[4-[4-(prop-2-enoylamino)butoxy]phenyl]diazenyl]benzenesulfonate Traditional Name: sodium 4-[4-(4-acrylamidobutoxy)phenyl]azobesylate Formula: C19H20N3NaO5S MolecularWeight: 425.43397

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)NCCCCOC1=CC=C(C=C1)N=NC2=CC=C(C=C2)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

C=CC(=O)NCCCCOC1=CC=C(C=C1)N=NC2=CC=C(C=C2)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C19H21N3O5S.Na/c1-2-19(23)20-13-3-4-14-27-17-9-5-15(6-10-17)21-22-16-7-11-18(12-8-16)28(24,25)26;/h2,5-12H,1,3-4,13-14H2,(H,20,23)(H,24,25,26);/q;+1/p-1