1-(1-propylbenzotriazol-5-yl)sulfonylpiperidine-3-carboxylic acid

Systemtic Name: 1-(1-propylbenzotriazol-5-yl)sulfonylpiperidine-3-carboxylic acid Openeye Name: 1-(1-propylbenzotriazol-5-yl)sulfonylpiperidine-3-carboxylic acid CAS Name: 1-[(1-propyl-5-benzotriazolyl)sulfonyl]-3-piperidinecarboxylic acid IUPAC Name: 1-(1-propylbenzotriazol-5-yl)sulfonylpiperidine-3-carboxylic acid Traditional Name: 1-(1-propylbenzotriazol-5-yl)sulfonylnipecotic acid Formula: C15H20N4O4S MolecularWeight: 352.4087

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC(C3)C(=O)O)N=N1

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC(C3)C(=O)O)N=N1

InChI

InChI=1S/C15H20N4O4S/c1-2-7-19-14-6-5-12(9-13(14)16-17-19)24(22,23)18-8-3-4-11(10-18)15(20)21/h5-6,9,11H,2-4,7-8,10H2,1H3,(H,20,21)