1-[(5-phenyl-1H-pyrazol-4-yl)methyl]azepane

Systemtic Name: 1-[(5-phenyl-1H-pyrazol-4-yl)methyl]azepane Openeye Name: 1-[(5-phenyl-1H-pyrazol-4-yl)methyl]azepane CAS Name: 1-[(5-phenyl-1H-pyrazol-4-yl)methyl]azepane IUPAC Name: 1-[(5-phenyl-1H-pyrazol-4-yl)methyl]azepane Traditional Name: 1-[(5-phenyl-1H-pyrazol-4-yl)methyl]azepane Formula: C16H21N3 MolecularWeight: 255.35804

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2=C(NN=C2)C3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)CC2=C(NN=C2)C3=CC=CC=C3

InChI

InChI=1S/C16H21N3/c1-2-7-11-19(10-6-1)13-15-12-17-18-16(15)14-8-4-3-5-9-14/h3-5,8-9,12H,1-2,6-7,10-11,13H2,(H,17,18)