2,3-dihydro-1,4-benzodioxin-6-yl-[1-(1-phenyl-1,2,3,4-tetrazol-5-yl)piperidin-4-yl]methanone

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[1-(1-phenyl-1,2,3,4-tetrazol-5-yl)piperidin-4-yl]methanone Openeye Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[1-(1-phenyltetrazol-5-yl)-4-piperidyl]methanone CAS Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[1-(1-phenyl-5-tetrazolyl)-4-piperidinyl]methanone IUPAC Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[1-(1-phenyltetrazol-5-yl)piperidin-4-yl]methanone Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[1-(1-phenyltetrazol-5-yl)-4-piperidyl]methanone Formula: C21H21N5O3 MolecularWeight: 391.42314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)C2=CC3=C(C=C2)OCCO3)C4=NN=NN4C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)C2=CC3=C(C=C2)OCCO3)C4=NN=NN4C5=CC=CC=C5

InChI

InChI=1S/C21H21N5O3/c27-20(16-6-7-18-19(14-16)29-13-12-28-18)15-8-10-25(11-9-15)21-22-23-24-26(21)17-4-2-1-3-5-17/h1-7,14-15H,8-13H2