(2S)-6-azanyl-2-[[4-[(4-dimethylaminophenyl)diazenyl]phenyl]sulfonylamino]hexanoic acid

Systemtic Name: (2S)-6-azanyl-2-[[4-[(4-dimethylaminophenyl)diazenyl]phenyl]sulfonylamino]hexanoic acid Openeye Name: (2S)-6-amino-2-[[4-(4-dimethylaminophenyl)azophenyl]sulfonylamino]hexanoic acid CAS Name: (2S)-6-amino-2-[[4-(4-dimethylaminophenyl)azophenyl]sulfonylamino]hexanoic acid IUPAC Name: (2S)-6-amino-2-[[4-[(4-dimethylaminophenyl)diazenyl]phenyl]sulfonylamino]hexanoic acid Traditional Name: (2S)-6-amino-2-[[4-(4-dimethylaminophenyl)azophenyl]sulfonylamino]hexanoic acid Formula: C20H27N5O4S MolecularWeight: 433.52448

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)S(=O)(=O)NC(CCCCN)C(=O)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)S(=O)(=O)N[C@@H](CCCCN)C(=O)O

InChI

InChI=1S/C20H27N5O4S/c1-25(2)17-10-6-15(7-11-17)22-23-16-8-12-18(13-9-16)30(28,29)24-19(20(26)27)5-3-4-14-21/h6-13,19,24H,3-5,14,21H2,1-2H3,(H,26,27)/t19-/m0/s1