6-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonyl-1-phenylmethoxy-benzotriazole

Systemtic Name: 6-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonyl-1-phenylmethoxy-benzotriazole Openeye Name: 1-benzyloxy-6-[[(3R,5R)-3,5-dimethyl-1-piperidyl]sulfonyl]benzotriazole CAS Name: 6-[[(3R,5R)-3,5-dimethyl-1-piperidinyl]sulfonyl]-1-phenylmethoxybenzotriazole IUPAC Name: 6-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonyl-1-phenylmethoxybenzotriazole Traditional Name: 1-benzoxy-6-[(3R,5R)-3,5-dimethylpiperidino]sulfonyl-benzotriazole Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=NN3OCC4=CC=CC=C4)C

Isomeric SMILES

C[C@@H]1C[C@H](CN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=NN3OCC4=CC=CC=C4)C

InChI

InChI=1S/C20H24N4O3S/c1-15-10-16(2)13-23(12-15)28(25,26)18-8-9-19-20(11-18)24(22-21-19)27-14-17-6-4-3-5-7-17/h3-9,11,15-16H,10,12-14H2,1-2H3/t15-,16-/m1/s1