1-[2-[4-[2-(3,5-dimethoxyphenyl)ethyl]piperidin-1-yl]sulfonylethyl]benzotriazole

Systemtic Name: 1-[2-[4-[2-(3,5-dimethoxyphenyl)ethyl]piperidin-1-yl]sulfonylethyl]benzotriazole Openeye Name: 1-[2-[[4-[2-(3,5-dimethoxyphenyl)ethyl]-1-piperidyl]sulfonyl]ethyl]benzotriazole CAS Name: 1-[2-[[4-[2-(3,5-dimethoxyphenyl)ethyl]-1-piperidinyl]sulfonyl]ethyl]benzotriazole IUPAC Name: 1-[2-[4-[2-(3,5-dimethoxyphenyl)ethyl]piperidin-1-yl]sulfonylethyl]benzotriazole Traditional Name: 1-[2-[4-[2-(3,5-dimethoxyphenyl)ethyl]piperidino]sulfonylethyl]benzotriazole Formula: C23H30N4O4S MolecularWeight: 458.5737

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CCC2CCN(CC2)S(=O)(=O)CCN3C4=CC=CC=C4N=N3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CCC2CCN(CC2)S(=O)(=O)CCN3C4=CC=CC=C4N=N3)OC

InChI

InChI=1S/C23H30N4O4S/c1-30-20-15-19(16-21(17-20)31-2)8-7-18-9-11-26(12-10-18)32(28,29)14-13-27-23-6-4-3-5-22(23)24-25-27/h3-6,15-18H,7-14H2,1-2H3