1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(5-pyridin-4-yl-1,2,3,4-tetrazol-2-yl)ethanone

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(5-pyridin-4-yl-1,2,3,4-tetrazol-2-yl)ethanone Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[5-(4-pyridyl)tetrazol-2-yl]ethanone CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(5-pyridin-4-yl-2-tetrazolyl)ethanone IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(5-pyridin-4-yltetrazol-2-yl)ethanone Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[5-(4-pyridyl)tetrazol-2-yl]ethanone Formula: C16H13N5O3 MolecularWeight: 323.30612

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C(=O)CN3N=C(N=N3)C4=CC=NC=C4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C(=O)CN3N=C(N=N3)C4=CC=NC=C4

InChI

InChI=1S/C16H13N5O3/c22-13(12-1-2-14-15(9-12)24-8-7-23-14)10-21-19-16(18-20-21)11-3-5-17-6-4-11/h1-6,9H,7-8,10H2