1-[(3R)-3-(1,3-benzodioxol-5-ylamino)piperidin-1-yl]-2-(benzotriazol-2-yl)ethanone

Systemtic Name: 1-[(3R)-3-(1,3-benzodioxol-5-ylamino)piperidin-1-yl]-2-(benzotriazol-2-yl)ethanone Openeye Name: 1-[(3R)-3-(1,3-benzodioxol-5-ylamino)-1-piperidyl]-2-(benzotriazol-2-yl)ethanone CAS Name: 1-[(3R)-3-(1,3-benzodioxol-5-ylamino)-1-piperidinyl]-2-(2-benzotriazolyl)ethanone IUPAC Name: 1-[(3R)-3-(1,3-benzodioxol-5-ylamino)piperidin-1-yl]-2-(benzotriazol-2-yl)ethanone Traditional Name: 1-[(3R)-3-(1,3-benzodioxol-5-ylamino)piperidino]-2-(benzotriazol-2-yl)ethanone Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CN2N=C3C=CC=CC3=N2)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1C[C@H](CN(C1)C(=O)CN2N=C3C=CC=CC3=N2)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C20H21N5O3/c26-20(12-25-22-16-5-1-2-6-17(16)23-25)24-9-3-4-15(11-24)21-14-7-8-18-19(10-14)28-13-27-18/h1-2,5-8,10,15,21H,3-4,9,11-13H2/t15-/m1/s1