methyl (2S)-3-methyl-2-[[4-(piperidin-1-yldiazenyl)phenyl]sulfonylamino]butanoate

Systemtic Name: methyl (2S)-3-methyl-2-[[4-(piperidin-1-yldiazenyl)phenyl]sulfonylamino]butanoate Openeye Name: methyl (2S)-3-methyl-2-[[4-(1-piperidylazo)phenyl]sulfonylamino]butanoate CAS Name: (2S)-3-methyl-2-[[4-(1-piperidinylazo)phenyl]sulfonylamino]butanoic acid methyl ester IUPAC Name: methyl (2S)-3-methyl-2-[[4-(piperidin-1-yldiazenyl)phenyl]sulfonylamino]butanoate Traditional Name: (2S)-3-methyl-2-[(4-piperidinoazophenyl)sulfonylamino]butyric acid methyl ester Formula: C17H26N4O4S MolecularWeight: 382.47774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NS(=O)(=O)C1=CC=C(C=C1)N=NN2CCCCC2

Isomeric SMILES

CC(C)[C@@H](C(=O)OC)NS(=O)(=O)C1=CC=C(C=C1)N=NN2CCCCC2

InChI

InChI=1S/C17H26N4O4S/c1-13(2)16(17(22)25-3)19-26(23,24)15-9-7-14(8-10-15)18-20-21-11-5-4-6-12-21/h7-10,13,16,19H,4-6,11-12H2,1-3H3/t16-/m0/s1