azepan-1-yl-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazol-4-yl]methanone

Systemtic Name: azepan-1-yl-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazol-4-yl]methanone Openeye Name: azepan-1-yl-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazol-4-yl]methanone CAS Name: 1-azepanyl-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazol-4-yl]methanone IUPAC Name: azepan-1-yl-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazol-4-yl]methanone Traditional Name: azepan-1-yl-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazol-4-yl]methanone Formula: C18H21N3O3 MolecularWeight: 327.37764

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=C(NN=C2)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=C(NN=C2)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C18H21N3O3/c22-18(21-7-3-1-2-4-8-21)14-12-19-20-17(14)13-5-6-15-16(11-13)24-10-9-23-15/h5-6,11-12H,1-4,7-10H2,(H,19,20)