4-[(4-phenyldiazenylphenyl)carbamoylsulfanyl]butanoic acid

Systemtic Name: 4-[(4-phenyldiazenylphenyl)carbamoylsulfanyl]butanoic acid Openeye Name: 4-[(4-phenylazophenyl)carbamoylsulfanyl]butanoic acid CAS Name: 4-[[oxo-(4-phenyldiazenylanilino)methyl]thio]butanoic acid IUPAC Name: 4-[(4-phenyldiazenylphenyl)carbamoylsulfanyl]butanoic acid Traditional Name: 4-[(4-phenylazophenyl)carbamoylthio]butyric acid Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=NC2=CC=C(C=C2)NC(=O)SCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N=NC2=CC=C(C=C2)NC(=O)SCCCC(=O)O

InChI

InChI=1S/C17H17N3O3S/c21-16(22)7-4-12-24-17(23)18-13-8-10-15(11-9-13)20-19-14-5-2-1-3-6-14/h1-3,5-6,8-11H,4,7,12H2,(H,18,23)(H,21,22)